Filtered Search Results
GSK 4716, Tocris Bioscience™
CAS: 101574-65-6 Molecular Formula: C17H18N2O2 Molecular Weight (g/mol): 282.34 MDL Number: MFCD00567155 InChI Key: IKPPIUNQWSRCOZ-WOJGMQOQSA-N Synonym: e-4-hydroxy-n'-4-isopropylbenzylidene benzohydrazide,4-hydroxy-benzoic acid 4-isopropyl-benzylidene-hydrazide,4-hydroxy-2-1e-4-1-methylethyl phenyl methylene hydrazide,2-4-1-methylethyl phenyl methylene hydrazide 4-hydroxybenzoic acid,2gpp,d0dx8t,gsk hplc,4-hydroxy-n-e-4-isopropylphenyl methyleneamino benzamide,4-hydroxy-n-e-4-propan-2-ylphenyl methylideneamino benzamide,4-hydroxy-n-1e-4-propan-2-yl phenyl methylidene benzohydrazide PubChem CID: 5331325 ChEBI: CHEBI:80000 IUPAC Name: 4-hydroxy-N'-[(E)-[4-(propan-2-yl)phenyl]methylidene]benzohydrazide SMILES: CC(C)C1=CC=C(\C=N\NC(=O)C2=CC=C(O)C=C2)C=C1
PubChem CID | 5331325 |
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CAS | 101574-65-6 |
Molecular Weight (g/mol) | 282.34 |
ChEBI | CHEBI:80000 |
MDL Number | MFCD00567155 |
SMILES | CC(C)C1=CC=C(\C=N\NC(=O)C2=CC=C(O)C=C2)C=C1 |
Synonym | e-4-hydroxy-n'-4-isopropylbenzylidene benzohydrazide,4-hydroxy-benzoic acid 4-isopropyl-benzylidene-hydrazide,4-hydroxy-2-1e-4-1-methylethyl phenyl methylene hydrazide,2-4-1-methylethyl phenyl methylene hydrazide 4-hydroxybenzoic acid,2gpp,d0dx8t,gsk hplc,4-hydroxy-n-e-4-isopropylphenyl methyleneamino benzamide,4-hydroxy-n-e-4-propan-2-ylphenyl methylideneamino benzamide,4-hydroxy-n-1e-4-propan-2-yl phenyl methylidene benzohydrazide |
IUPAC Name | 4-hydroxy-N'-[(E)-[4-(propan-2-yl)phenyl]methylidene]benzohydrazide |
InChI Key | IKPPIUNQWSRCOZ-WOJGMQOQSA-N |
Molecular Formula | C17H18N2O2 |
U 73343, Tocris Bioscience™
CAS: 142878-12-4 Molecular Formula: C29H42N2O3 Molecular Weight (g/mol): 466.67 MDL Number: MFCD00211221 InChI Key: CJHWFIUASFBCKN-ZRJUGLEFSA-N Synonym: unii-s2c4j8704c,1-6-17beta-3-methoxyestra-1,3,5 10-triene-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl-amino hexyl-2,5-pyrrolidine-dione,1/6/2017,a-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17?-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidine-dione,1-6-8r,9s,13s,14s,17s-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta a phenanthren-17-yl amino hexyl pyrrolidine-2,5-dione,2,5-pyrrolidinedione, 1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl PubChem CID: 114825 IUPAC Name: 1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]amino}hexyl)pyrrolidine-2,5-dione SMILES: COC1=CC=C2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCC2=C1)NCCCCCCN1C(=O)CCC1=O
PubChem CID | 114825 |
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CAS | 142878-12-4 |
Molecular Weight (g/mol) | 466.67 |
MDL Number | MFCD00211221 |
SMILES | COC1=CC=C2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCC2=C1)NCCCCCCN1C(=O)CCC1=O |
Synonym | unii-s2c4j8704c,1-6-17beta-3-methoxyestra-1,3,5 10-triene-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl-amino hexyl-2,5-pyrrolidine-dione,1/6/2017,a-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17?-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidinedione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-2,5-pyrrolidine-dione,1-6-8r,9s,13s,14s,17s-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta a phenanthren-17-yl amino hexyl pyrrolidine-2,5-dione,2,5-pyrrolidinedione, 1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl |
IUPAC Name | 1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]amino}hexyl)pyrrolidine-2,5-dione |
InChI Key | CJHWFIUASFBCKN-ZRJUGLEFSA-N |
Molecular Formula | C29H42N2O3 |
Forskolin, Tocris Bioscience™
CAS: 66575-29-9 Molecular Formula: C22H34O7 Molecular Weight (g/mol): 410.507 InChI Key: OHCQJHSOBUTRHG-KGGHGJDLSA-N Synonym: forskolin,colforsin,coleonol,colforsina,colforsine,colforsinum,boforsin,colforsine french,colforsinum latin,colforsina spanish PubChem CID: 47936 ChEBI: CHEBI:42471 IUPAC Name: [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate SMILES: CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O
PubChem CID | 47936 |
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CAS | 66575-29-9 |
Molecular Weight (g/mol) | 410.507 |
ChEBI | CHEBI:42471 |
SMILES | CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O |
Synonym | forskolin,colforsin,coleonol,colforsina,colforsine,colforsinum,boforsin,colforsine french,colforsinum latin,colforsina spanish |
IUPAC Name | [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate |
InChI Key | OHCQJHSOBUTRHG-KGGHGJDLSA-N |
Molecular Formula | C22H34O7 |
R&D Systems™ Recombinant Human Neurexin 2 alpha Isoform 2 Fc Chimera
Extensive quality control produces industry leading bioactivity and lot-to-lot consistency that instills confidence in results and ensures reproducibility. Applications: Bioactivity
Taxol, Tocris Bioscience™
CAS: 33069-62-4 Molecular Formula: C47H51NO14 Molecular Weight (g/mol): 853.92 MDL Number: MFCD00869953 InChI Key: RCINICONZNJXQF-VAZQATRQSA-N Synonym: paclitaxel,taxol,taxol a,abraxane,paxene,paxceed,plaxicel,yewtaxan,onxol,ebetaxel PubChem CID: 133640187 IUPAC Name: (1S,2S,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate SMILES: CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1
PubChem CID | 133640187 |
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CAS | 33069-62-4 |
Molecular Weight (g/mol) | 853.92 |
MDL Number | MFCD00869953 |
SMILES | CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1 |
Synonym | paclitaxel,taxol,taxol a,abraxane,paxene,paxceed,plaxicel,yewtaxan,onxol,ebetaxel |
IUPAC Name | (1S,2S,4S,7R,9S,10S,12R,15S)-4,12-bis(acetyloxy)-1,9-dihydroxy-15-{[(2R,3S)-2-hydroxy-3-phenyl-3-(phenylformamido)propanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate |
InChI Key | RCINICONZNJXQF-VAZQATRQSA-N |
Molecular Formula | C47H51NO14 |
U 73122, Tocris Bioscience™
CAS: 112648-68-7 Molecular Formula: C29H40N2O3 Molecular Weight (g/mol): 464.65 MDL Number: MFCD00893825,MFCD12910450 InChI Key: LUFAORPFSVMJIW-ZRJUGLEFSA-N Synonym: 1-6-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1h-pyrrole-2,5-dione, 1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1-6-17-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,d04por,1-6-17beta-3-methoxyestra-1 10 ,2,4-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl pyrrole-2,5-dione,1-6-17?-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1-6-8r,9s,13s,14s,17s-3-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6h-cyclopenta a phenanthren-17-yl amino hexyl-1h-pyrrole-2,5-dione PubChem CID: 104794 IUPAC Name: 1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]amino}hexyl)-2,5-dihydro-1H-pyrrole-2,5-dione SMILES: COC1=CC=C2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCC2=C1)NCCCCCCN1C(=O)C=CC1=O
PubChem CID | 104794 |
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CAS | 112648-68-7 |
Molecular Weight (g/mol) | 464.65 |
MDL Number | MFCD00893825,MFCD12910450 |
SMILES | COC1=CC=C2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCC2=C1)NCCCCCCN1C(=O)C=CC1=O |
Synonym | 1-6-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1h-pyrrole-2,5-dione, 1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1-6-17-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,d04por,1-6-17beta-3-methoxyestra-1 10 ,2,4-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1-6-17beta-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl pyrrole-2,5-dione,1-6-17?-3-methoxyestra-1,3,5 10-trien-17-yl amino hexyl-1h-pyrrole-2,5-dione,1-6-8r,9s,13s,14s,17s-3-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6h-cyclopenta a phenanthren-17-yl amino hexyl-1h-pyrrole-2,5-dione |
IUPAC Name | 1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]amino}hexyl)-2,5-dihydro-1H-pyrrole-2,5-dione |
InChI Key | LUFAORPFSVMJIW-ZRJUGLEFSA-N |
Molecular Formula | C29H40N2O3 |
L-NMMA acetate, Tocris Bioscience™
CAS: 53308-83-1 Molecular Formula: C9H20N4O4 Molecular Weight (g/mol): 248.283 InChI Key: IKPNWIGTWUZCKM-JEDNCBNOSA-N Synonym: tilarginine acetate,l-nmma,l-nmma acetate,ng-monomethyl-l-arginine acetate,nomega-me-l-arg,unii-2fl3530af2,ng-me-l-arg, acoh,tilarginine acetate usan,ng-methyl-l-arginine acetate salt,l-ornithine, n5-imino methylamino methyl-cas PubChem CID: 135242 IUPAC Name: acetic acid;(2S)-2-amino-5-[(N'-methylcarbamimidoyl)amino]pentanoic acid SMILES: CC(=O)O.CN=C(N)NCCCC(C(=O)O)N
PubChem CID | 135242 |
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CAS | 53308-83-1 |
Molecular Weight (g/mol) | 248.283 |
SMILES | CC(=O)O.CN=C(N)NCCCC(C(=O)O)N |
Synonym | tilarginine acetate,l-nmma,l-nmma acetate,ng-monomethyl-l-arginine acetate,nomega-me-l-arg,unii-2fl3530af2,ng-me-l-arg, acoh,tilarginine acetate usan,ng-methyl-l-arginine acetate salt,l-ornithine, n5-imino methylamino methyl-cas |
IUPAC Name | acetic acid;(2S)-2-amino-5-[(N'-methylcarbamimidoyl)amino]pentanoic acid |
InChI Key | IKPNWIGTWUZCKM-JEDNCBNOSA-N |
Molecular Formula | C9H20N4O4 |
Ko 143, Tocris Bioscience™
CAS: 461054-93-3 Molecular Formula: C26H35N3O5 Molecular Weight (g/mol): 469.58 MDL Number: MFCD11042273,MFCD19053160 InChI Key: NXNRAECHCJZNRF-UHFFFAOYNA-N Synonym: tert-butyl 3-3s,6s,12as-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino 1',2':1,6 pyrido 3,4-b indol-3-yl propanoate,ko143 hydrate,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,3s,6s,12as-,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester hydrate,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl 1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1,2:1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,1,1-dimethylethyl 3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoate,3-3s,6s-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydro-pyrazino 1,2:1,6 pyrido 3,4-b indol-3-yl-propionic acid tert-butyl ester,3-3s,6s,12as-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydro-pyrazino 1,2:1,6 pyrido 3,4-b indol-3-yl-propionic acid tert-butyl ester PubChem CID: 10322450 IUPAC Name: tert-butyl 3-[14-methoxy-2-(2-methylpropyl)-4,7-dioxo-3,6,17-triazatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁶]heptadeca-1(10),11,13,15-tetraen-5-yl]propanoate SMILES: COC1=CC=C2C(NC3=C2CC2N(C3CC(C)C)C(=O)C(CCC(=O)OC(C)(C)C)NC2=O)=C1
PubChem CID | 10322450 |
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CAS | 461054-93-3 |
Molecular Weight (g/mol) | 469.58 |
MDL Number | MFCD11042273,MFCD19053160 |
SMILES | COC1=CC=C2C(NC3=C2CC2N(C3CC(C)C)C(=O)C(CCC(=O)OC(C)(C)C)NC2=O)=C1 |
Synonym | tert-butyl 3-3s,6s,12as-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino 1',2':1,6 pyrido 3,4-b indol-3-yl propanoate,ko143 hydrate,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,3s,6s,12as-,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester hydrate,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl 1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1,2:1,6 pyrido 3,4-b indole-3-propanoic acid 1,1-dimethylethyl ester,1,1-dimethylethyl 3s,6s,12as-1,2,3,4,6,7,12,12a-octahydro-9-methoxy-6-2-methylpropyl-1,4-dioxopyrazino 1',2':1,6 pyrido 3,4-b indole-3-propanoate,3-3s,6s-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydro-pyrazino 1,2:1,6 pyrido 3,4-b indol-3-yl-propionic acid tert-butyl ester,3-3s,6s,12as-6-isobutyl-9-methoxy-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydro-pyrazino 1,2:1,6 pyrido 3,4-b indol-3-yl-propionic acid tert-butyl ester |
IUPAC Name | tert-butyl 3-[14-methoxy-2-(2-methylpropyl)-4,7-dioxo-3,6,17-triazatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁶]heptadeca-1(10),11,13,15-tetraen-5-yl]propanoate |
InChI Key | NXNRAECHCJZNRF-UHFFFAOYNA-N |
Molecular Formula | C26H35N3O5 |
Betulinic acid, Tocris Bioscience™
CAS: 472-15-1 Molecular Formula: C30H48O3 Molecular Weight (g/mol): 456.711 InChI Key: QGJZLNKBHJESQX-FZFNOLFKSA-N Synonym: betulinic acid,mairin,betulic acid,ccris 6748,3-hydroxylup-20 29-en-28-oic acid,3beta-hydroxy-20 29-lupaene-28-oic acid,3beta-hydroxy-lup-20 29-en-28-oic acid,lup-20 29-en-28-oic acid, 3-hydroxy-, 3beta,1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br-9-hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta a chrysene-3a-carboxylic acid,1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta a chrysene-3a-carboxylic acid PubChem CID: 64971 ChEBI: CHEBI:3087 IUPAC Name: (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid SMILES: CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O
PubChem CID | 64971 |
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CAS | 472-15-1 |
Molecular Weight (g/mol) | 456.711 |
ChEBI | CHEBI:3087 |
SMILES | CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O |
Synonym | betulinic acid,mairin,betulic acid,ccris 6748,3-hydroxylup-20 29-en-28-oic acid,3beta-hydroxy-20 29-lupaene-28-oic acid,3beta-hydroxy-lup-20 29-en-28-oic acid,lup-20 29-en-28-oic acid, 3-hydroxy-, 3beta,1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br-9-hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta a chrysene-3a-carboxylic acid,1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta a chrysene-3a-carboxylic acid |
IUPAC Name | (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid |
InChI Key | QGJZLNKBHJESQX-FZFNOLFKSA-N |
Molecular Formula | C30H48O3 |