(3β,20α,21α)-3,21-Dihydroxy-11-oxoolean-12-en-29-oic acid
CAS Registry Number®
22327-86-2
CAS Name
(3β,20α,21α)-3,21-Dihydroxy-11-oxoolean-12-en-29-oic acidMolecular Formula
C30H46O5Molecular Mass
486.68Cite this Page
(3β,20α,21α)-3,21-Dihydroxy-11-oxoolean-12-en-29-oic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=22327-86-2 (retrieved ) (CAS RN: 22327-86-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
329-333 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C30H46O5/c1-25(2)20-8-11-30(7)23(27(20,4)10-9-21(25)32)19(31)14-17-18-15-28(5,24(34)35)22(33)16-26(18,3)12-13-29(17,30)6/h14,18,20-23,32-33H,8-13,15-16H2,1-7H3,(H,34,35)/t18-,20-,21-,22+,23+,26-,27-,28-,29+,30+/m0/s1
InChIKey
InChIKey=HFTWTHSIMCSLFQ-CMLLUXCUSA-N
SMILES
C[C@]12[C@@]([C@]3(C)[C@@](CC1)(C(C)(C)[C@@H](O)CC3)[H])(C(=O)C=C4[C@@]2(C)CC[C@]5(C)[C@]4(C[C@@](C(O)=O)(C)[C@H](O)C5)[H])[H]
Canonical SMILES
O=C(O)C1(C)CC2C3=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)CC1O
Other Names for this Substance
- Olean-12-en-29-oic acid, 3,21-dihydroxy-11-oxo-, (3β,20α,21α)-
- Glabric acid
- (3β,20α,21α)-3,21-Dihydroxy-11-oxoolean-12-en-29-oic acid