(1R,2S,4aS,4bS,7R,8S,8aS)-8-(hydroxymethyl)-4b,8-dimethyl-2-(3-oxidanylprop-1-en-2-yl)-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol

Systemtic Name: (1R,2S,4aS,4bS,7R,8S,8aS)-8-(hydroxymethyl)-4b,8-dimethyl-2-(3-oxidanylprop-1-en-2-yl)-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol Openeye Name: (1R,2S,4aS,4bS,7R,8S,8aS)-8-(hydroxymethyl)-2-[1-(hydroxymethyl)vinyl]-4b,8-dimethyl-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol CAS Name: (1R,2S,4aS,4bS,7R,8S,8aS)-8-(hydroxymethyl)-2-(3-hydroxyprop-1-en-2-yl)-4b,8-dimethyl-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol IUPAC Name: (1R,2S,4aS,4bS,7R,8S,8aS)-8-(hydroxymethyl)-2-(3-hydroxyprop-1-en-2-yl)-4b,8-dimethyl-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol Traditional Name: (1R,2S,4aS,4bS,7R,8S,8aS)-4b,8-dimethyl-8-methylol-2-(1-methylolvinyl)-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol Formula: C20H32O4 MolecularWeight: 336.46568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(C(C1CC=C3C2CCC(C3O)C(=C)CO)(C)CO)O

Isomeric SMILES

C[C@@]12CC[C@H]([C@]([C@H]1CC=C3[C@H]2CC[C@H]([C@H]3O)C(=C)CO)(C)CO)O

InChI

InChI=1S/C20H32O4/c1-12(10-21)13-4-6-15-14(18(13)24)5-7-16-19(15,2)9-8-17(23)20(16,3)11-22/h5,13,15-18,21-24H,1,4,6-11H2,2-3H3/t13-,15+,16-,17+,18+,19-,20+/m0/s1