(2R)-6-methyl-2-[(3S,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxidanyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]heptane-1,5,6-triol

Systemtic Name: (2R)-6-methyl-2-[(3S,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxidanyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]heptane-1,5,6-triol Openeye Name: (2R)-2-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-heptane-1,5,6-triol CAS Name: (2R)-2-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylheptane-1,5,6-triol IUPAC Name: (2R)-2-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylheptane-1,5,6-triol Traditional Name: (2R)-2-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-heptane-1,5,6-triol Formula: C30H50O4 MolecularWeight: 474.7156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC2(C1CC=C3C2=CCC4(C3(CCC4C(CCC(C(C)(C)O)O)CO)C)C)C)O)C

Isomeric SMILES

C[C@]12CC[C@@H](C(C1CC=C3C2=CC[C@]4([C@]3(CC[C@@H]4[C@@H](CCC(C(C)(C)O)O)CO)C)C)(C)C)O

InChI

InChI=1S/C30H50O4/c1-26(2)23-10-9-22-21(28(23,5)15-14-24(26)32)13-17-29(6)20(12-16-30(22,29)7)19(18-31)8-11-25(33)27(3,4)34/h9,13,19-20,23-25,31-34H,8,10-12,14-18H2,1-7H3/t19-,20+,23?,24-,25?,28+,29+,30-/m0/s1