Oleanane-3,11,13-triol, (3β,11α)-
CAS Registry Number®
85643-69-2
CAS Name
Oleanane-3,11,13-triol, (3β,11α)-Molecular Formula
C30H52O3Molecular Mass
460.73Cite this Page
Oleanane-3,11,13-triol, (3β,11α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=85643-69-2 (retrieved ) (CAS RN: 85643-69-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H52O3/c1-24(2)13-14-26(5)15-16-29(8)28(7)12-9-20-25(3,4)22(32)10-11-27(20,6)23(28)19(31)17-30(29,33)21(26)18-24/h19-23,31-33H,9-18H2,1-8H3/t19-,20+,21-,22+,23-,26-,27+,28-,29+,30+/m1/s1
InChIKey
InChIKey=PVMLWBWORNCCPQ-IVJFEJAPSA-N
SMILES
C[C@]12[C@@]3(C)[C@@]([C@]4(C)[C@@](CC3)(C(C)(C)[C@@H](O)CC4)[H])([C@H](O)C[C@]1(O)[C@]5([C@@](C)(CC2)CCC(C)(C)C5)[H])[H]
Canonical SMILES
OC1CC2(O)C3CC(C)(C)CCC3(C)CCC2(C)C4(C)CCC5C(C)(C)C(O)CCC5(C)C14
Other Names for this Substance
- Oleanane-3,11,13-triol, (3β,11α)-