(1R,3AS,5AR,5BR,7AR,9S,11AR,11BR,13AR,13BR)-3A-(HYDROXYMETHYL)-5A,5B,8,8,11A-PENTAMETHYL-1-(PROP-1-EN-2-YL)-ICOSAHYDRO-1H-CYCLOPENTA[A]CHRYSEN-9-OL | CAS 473-98-3

Catalog Id:
MM473983

IUPAC:
BETULIN

CAS Number:
473-98-3

Molecular Weight:
442.728

Formula:
C30H50O2

SMILES:
CC(=C)[C@@H]1CC[C@]2(CO)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

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

InChIKey:
InChIKey=FVWJYYTZTCVBKE-ROUWMTJPSA-N

Categories:
Aliphatic Cyclic Structures, Aromatic Heterocycles, Alcohols, Primary Alcohols, Secondary Alcohols

Synonyms:
Betulin