(1S,3aR,5aR,5bR,7aS,11aS,11bS,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-11-ol

Systemtic Name: (1S,3aR,5aR,5bR,7aS,11aS,11bS,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-11-ol Openeye Name: (1S,3aR,5aR,5bR,7aS,11aS,11bS,13aR,13bR)-1-isopropyl-3a,5a,5b,8,8,11a-hexamethyl-1,2,3,4,5,6,7,7a,9,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-11-ol CAS Name: (1S,3aR,5aR,5bR,7aS,11aS,11bS,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-11-ol IUPAC Name: (1S,3aR,5aR,5bR,7aS,11aS,11bS,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-11-ol Traditional Name: (1S,3aR,5aR,5bR,7aS,11aS,11bS,13aR,13bR)-1-isopropyl-3a,5a,5b,8,8,11a-hexamethyl-1,2,3,4,5,6,7,7a,9,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-11-ol Formula: C30H50O MolecularWeight: 426.7174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(=CCC5(C)C)O)C)C)C

Isomeric SMILES

CC(C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@H]4[C@]([C@@]3(CC2)C)(CC[C@@H]5[C@@]4(C(=CCC5(C)C)O)C)C)C

InChI

InChI=1S/C30H50O/c1-19(2)20-11-15-27(5)17-18-28(6)21(25(20)27)9-10-23-29(28,7)16-12-22-26(3,4)14-13-24(31)30(22,23)8/h13,19-23,25,31H,9-12,14-18H2,1-8H3/t20-,21+,22-,23-,25+,27+,28+,29+,30-/m0/s1