(4R,4aS,6R,6aS,6bS,8aR,12aR,14aS)-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-6-oxidanyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one

Systemtic Name: (4R,4aS,6R,6aS,6bS,8aR,12aR,14aS)-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-6-oxidanyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one Openeye Name: (4R,4aS,6R,6aS,6bS,8aR,12aR,14aS)-6-hydroxy-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one CAS Name: (4R,4aS,6R,6aS,6bS,8aR,12aR,14aS)-6-hydroxy-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one IUPAC Name: (4R,4aS,6R,6aS,6bS,8aR,12aR,14aS)-6-hydroxy-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one Traditional Name: (4R,4aS,6R,6aS,6bS,8aR,12aR,14aS)-6-hydroxy-4,4a,6a,8a,11,11,14a-heptamethyl-6b-methylol-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one Formula: C30H50O3 MolecularWeight: 458.7162

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)CCC2C1(CC(C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)CO)C)C)O)C

Isomeric SMILES

C[C@H]1C(=O)CCC2[C@@]1(C[C@H](C3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C)CO)C)C)O)C

InChI

InChI=1S/C30H50O3/c1-19-20(32)8-9-22-27(5)13-14-29(7)23-17-25(2,3)10-11-26(23,4)12-15-30(29,18-31)24(27)21(33)16-28(19,22)6/h19,21-24,31,33H,8-18H2,1-7H3/t19-,21+,22?,23+,24?,26+,27-,28+,29-,30-/m0/s1