(1R,3AS,5AR,5BR,7AR,9S,11AR,11BR,13AR,13BR)-9-HYDROXY-5A,5B,8,8,11A-PENTAMETHYL-1-(PROP-1-EN-2-YL)-ICOSAHYDRO-1H-CYCLOPENTA[A]CHRYSENE-3A-CARBOXYLIC ACID | CAS 472-15-1

Catalog Id:
MM472151

IUPAC:
BETULINICACID

CAS Number:
472-15-1

Molecular Weight:
456.711

Formula:
C30H48O3

SMILES:
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O

Preferred IUPAC Name:
(1R,3AS,5AR,5BR,7AR,9S,11AR,11BR,13AR,13BR)-9-HYDROXY-5A,5B,8,8,11A-PENTAMETHYL-1-(PROP-1-EN-2-YL)-ICOSAHYDRO-1H-CYCLOPENTA[A]CHRYSENE-3A-CARBOXYLIC ACID

InChIKey:
InChIKey=QGJZLNKBHJESQX-FZFNOLFKSA-N

Categories:
Aliphatic Cyclic Structures, Aromatic Heterocycles, Alcohols, Secondary Alcohols, Carboxylic Acids, Aliphatic Carboxylic Acids

Synonyms:
Betulinic Acid