Olean-12-en-28-oic acid, 2,3,23-tris(acetyloxy)-19-hydroxy-, (2α,3β,4β,19α)-
CAS Registry Number®
58096-15-4
CAS Name
Olean-12-en-28-oic acid, 2,3,23-tris(acetyloxy)-19-hydroxy-, (2α,3β,4β,19α)-Molecular Formula
C36H54O9Molecular Mass
630.81Cite this Page
Olean-12-en-28-oic acid, 2,3,23-tris(acetyloxy)-19-hydroxy-, (2α,3β,4β,19α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=58096-15-4 (retrieved ) (CAS RN: 58096-15-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C36H54O9/c1-20(37)43-19-33(7)25-12-13-35(9)26(32(25,6)18-24(44-21(2)38)29(33)45-22(3)39)11-10-23-27-28(40)31(4,5)14-16-36(27,30(41)42)17-15-34(23,35)8/h10,24-29,40H,11-19H2,1-9H3,(H,41,42)/t24-,25-,26-,27-,28+,29+,32+,33-,34-,35-,36+/m1/s1
InChIKey
InChIKey=YZUXOBYCNWIMKP-UMILUGPZSA-N
SMILES
C(O)(=O)[C@]12[C@](C=3[C@@](C)(CC1)[C@@]4(C)[C@](CC3)([C@]5(C)[C@@](CC4)([C@](COC(C)=O)(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C5)[H])[H])([C@H](O)C(C)(C)CC2)[H]
Canonical SMILES
O=C(OCC1(C)C(OC(=O)C)C(OC(=O)C)CC2(C)C3CC=C4C5C(O)C(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC12)C
Other Names for this Substance
- Olean-12-en-28-oic acid, 2,3,23-tris(acetyloxy)-19-hydroxy-, (2α,3β,4β,19α)-