(3Beta)-stigmast-5-en-3-yl benzoate

CAS

1900-52-3

Catalog Number

ACM1900523

Category

Other Products

Molecular Weight

518.812760 [g/mol]

Molecular Formula

C₃₆H₅₄O₂

MSDS COA Spec Sheet

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Specification

Synonyms

(3|A)-stigmast-5-en-3-yl benzoate, 1900-52-3, AC1L2SBA, CTK4E0284, KST-1A2425, EINECS 217-597-0, AR-1A4928, (3beta)-Stigmast-5-en-3-yl benzoate, AG-E-38750, Stigmast-5-en-3-ol,3-benzoate, (3b)-, [(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate, Stigmast-5-en-3-ol,benzoate, (3b)-(9CI); Stigmast-5-en-3b-ol, benzoate (8CI); b-Sitosterol, benzoate (6CI,7CI); 3b-Benzoyl-b-sitosterol; Nimbosterol, benzoate; Phellodendron sterol B, benzoate;Sitosterol benzoate; Sitosteryl benzoate

IUPAC Name

[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate

Canonical SMILES

CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C5=CC=CC=C5)C)C)C(C)C

InChI Key

WFQRUMHMFCGSRO-XKKOIZAZSA-N

Boiling Point

582.5ºC at 760mmHg

Flash Point

260.4ºC

Density

1.02g/cm³

EC Number

217-597-0