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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C(CC(C3C2C(CC4C3C(=O)CC(C4(C)CO)O)C)C)C5C1CCC(C5C)(C)C

Isomeric SMILES

C[C@@H]1CC2C(C[C@H](C3C2[C@H](CC4C3C(=O)CC([C@@]4(C)CO)O)C)C)C5C1CCC([C@@H]5C)(C)C

InChI

InChI=1S/C30H50O3/c1-15-10-20-21(27-18(4)29(5,6)9-8-19(15)27)11-16(2)26-25(20)17(3)12-22-28(26)23(32)13-24(33)30(22,7)14-31/h15-22,24-28,31,33H,8-14H2,1-7H3/t15-,16-,17+,18-,19?,20?,21?,22?,24?,25?,26?,27?,28?,30+/m1/s1