3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-2-enyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol

Systemtic Name: 3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-2-enyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol Openeye Name: 1-allyl-3a-(hydroxymethyl)-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-9,11-diol CAS Name: 3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-2-enyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol IUPAC Name: 3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-2-enyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol Traditional Name: 1-allyl-5a,5b,8,8,11a-pentamethyl-3a-methylol-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11-diol Formula: C30H50O3 MolecularWeight: 458.7162

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC3(C(C2(C(CC1O)O)C)CCC4C3(CCC5(C4C(CC5)CC=C)CO)C)C)C

Isomeric SMILES

CC1(C2CCC3(C(C2(C(CC1O)O)C)CCC4C3(CCC5(C4C(CC5)CC=C)CO)C)C)C

InChI

InChI=1S/C30H50O3/c1-7-8-19-11-14-30(18-31)16-15-27(4)20(25(19)30)9-10-22-28(27,5)13-12-21-26(2,3)23(32)17-24(33)29(21,22)6/h7,19-25,31-33H,1,8-18H2,2-6H3