alpha-Spinasterol acetate

Inquiry

For Research Use Only.

Category

Steroids

Cat.No.

NP6212

CAS

4651-46-1

Product Name

alpha-Spinasterol acetate

Structure

Product Details

Description

alpha-Spinasterol acetate isolated from the herbs of Inula britannica L.

Synonyms

(3β,5α,22E)-Stigmasta-7,22-dien-3-yl acetate

IUPAC Name

[(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Molecular Weight

454.7

Molecular Formula

C31H50O2

Canonical SMILES

CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)OC(=O)C)C)C)C(C)C

InChI

InChI=1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-10,12,20-21,23-25,27-29H,8,11,13-19H2,1-7H3/b10-9+/t21-,23-,24+,25+,27-,28+,29+,30+,31-/m1/s1

InChIKey

VQLULFBGTFJDEB-LSEHKVPYSA-N

Purity

> 95%

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