MW: 414.72
CAS: 83-46-5
TNP NUMBER: TNP00383
MDL NUMBER: MFCD01821071
IUPAC: 14-((1S,4R)-4-ethyl-1,5-dimethylhexyl)(1S,5S,10S,11S,2R,14R,15R)-2,15-dimethyl tetracyclo[8.7.0.0<2,7>.0<11,15>]heptadec-7-en-5-ol
Smiles: C12=CC[C@@H]3([C@@H]([C@@]1(C)CC[C@@H](C2)O)(CC[C]1(C)[C@H]3(CC[C@@H]1[C@@H](CC[C@H](C(C)C)CC)C)))
beta-Sitosterol, with ca. 10% campesterol, ca. 75% beta-sitosterol
THERAPEUTIC CATEGORY: Anticholesteremic. Treatment of prostaic adenoma
SOURCE: Common sterol in plants
ACCEPTORS: 1
DONORS: 1
ROTATION BONDS: 4
N+O: 1
Chiral Centers: 9
LogP: 12.09
LogS: -7.77
LIPINSKI: 3
Synonyms: B-SITOSTEROL;BETA-SITOSTEROL;A-PHYTOSTEROL;CINCHOL;22,23-DIHYDROSTIMASTEROL;22,23-DIHYDROSTIGMASTEROL;24-ALPHA-ETHYLCHOLESTEROL;24BETA-ETHYLCHOLESTEROL
CAS:83-46-5
MF:C29H50O
MW:414.71
EINECS:201-480-6
Product Categories:Miscellaneous Natural Products;Biochemistry;Hydroxysteroids;Steroids;Natural Plant Extract beta-Sitosterol
Chemical Properties: mp 136-140 C(lit.) alpha -28 (c=2, CHCl3) storage temp. -20C solubility chloroform: 20 mg/mL, clear, colorless Water Solubility INSOLUBLE Merck 8556
CAS DataBase Reference: 83-46-5(
CAS DataBase Reference: ) NIST Chemistry Reference
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