Description
3-Hydroxy-12-oleanene-23,28-dioic acid is a natural compound of immense interest in the biomedical field, showcasing remarkable capabilities in studying a plethora of ailments encompassing cancer, inflammation and metabolic disorders.
Synonyms
3-Hydroxy-12-oleanene-23,28-dioic acid226562-47-6(6AR,6BS,8AS,12AR,14AR,14BR)-3-HYDROXY-4,6A,6B,11,11,14B-HEXAMETHYL-1,2,3,4A,5,6,7,8,9,10,12,12A,14,14A-TETRADECAHYDROPICENE-4,8A-DICARBOXYLIC ACID3-Hydroxy-12-oleanene-23,28-dioicacidW2516
IUPAC Name
(6aR,6bS,8aS,12aR,14aR,14bR)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
Molecular Formula
C30H46O5
Canonical SMILES
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C(=O)O)O)C)C)C2C1)C)C(=O)O)C
InChI
InChI=1S/C30H46O5/c1-25(2)13-15-30(24(34)35)16-14-27(4)18(19(30)17-25)7-8-20-26(3)11-10-22(31)29(6,23(32)33)21(26)9-12-28(20,27)5/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20-,21?,22?,26-,27-,28-,29?,30+/m1/s1
InChIKey
PAIBKVQNJKUVCE-QPHRCCSXSA-N