Urs-12-en-28-oic acid, 3-(benzoyloxy)-11-oxo-, (3β)-
CAS Registry Number®
205699-23-6
CAS Name
Urs-12-en-28-oic acid, 3-(benzoyloxy)-11-oxo-, (3β)-Molecular Formula
C37H50O5Molecular Mass
574.79Cite this Page
Urs-12-en-28-oic acid, 3-(benzoyloxy)-11-oxo-, (3β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=205699-23-6 (retrieved ) (CAS RN: 205699-23-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C37H50O5/c1-22-13-18-37(32(40)41)20-19-35(6)25(29(37)23(22)2)21-26(38)30-34(5)16-15-28(42-31(39)24-11-9-8-10-12-24)33(3,4)27(34)14-17-36(30,35)7/h8-12,21-23,27-30H,13-20H2,1-7H3,(H,40,41)/t22-,23+,27+,28+,29+,30-,34+,35-,36-,37+/m1/s1
InChIKey
InChIKey=RGCBYGZECVEZKC-JOWDIJJKSA-N
SMILES
C[C@]12[C@@]3(C)C([C@]4([C@@](C(O)=O)(CC3)CC[C@@H](C)[C@@H]4C)[H])=CC(=O)[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@@H](OC(=O)C6=CC=CC=C6)CC5)[H])[H]
Canonical SMILES
O=C(OC1CCC2(C)C3C(=O)C=C4C5C(C)C(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C1(C)C)C=6C=CC=CC6
Other Names for this Substance
- Urs-12-en-28-oic acid, 3-(benzoyloxy)-11-oxo-, (3β)-