Heliantriol C

(3S,4aR,6aR,6aR,6bR,8S,8aS,9S,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8,9-triol

Also Known As: Heliantriol C|(18alpha,19alpha)-Urs-20-ene-3beta,16beta,22alpha-triol|18alpha,19alpha-Urs-20-ene-3beta,16beta,22alpha-triol|(3S,16S,22S,18R,19S)-Urs-20-ene-3,16,22-triol|(3S,4aR,6aR,6aR,6bR,8S,8aS,9S,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8,9-triol|(3S,4aR,6aR,6aR,6bR,8S,8aS,9S,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8,9-triol|(3S,4aR,6aR,6bR,8S,8aS,9S,12S,12aR,12bR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,12,12a,12b,13,14,14a,14b-icosahydropicene-3,8,9-triol

Molecular Formula	C30H50O3
Molecular Weight	458.376 g/mol
LogP	5.9664
Topological Polar Surface Area	60.69 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	458.376
Monoisotopic Mass	458.376
Heavy Atoms	33
Complexity	847.4798

Chemical Identifiers

CAS Number	71876-60-3
SMILES	C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(C[C@@H]([C@]2([C@H](C=C1C)O)C)O)C)C)(C)C)O)C