Description
α-Spinasterol glucoside is a natural product found in Silene firma and Senegalia pennata, and isolated from the herbs of Inula britannica L.
Synonyms
α-Spinasteryl-3-O-β-D-glucoside; (3β,5α,22E)-Stigmasta-7,22-dien-3-yl β-D-glucopyranoside; alpha-Spinasterol glucoside; Spinasteryl glucoside; Chondrillasterol 3-O-beta-D-glucopyranoside; a-Spinasteryl b-D-glucoside
IUPAC Name
(2R,3R,4S,5S,6R)-2-[[(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]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Formula
C35H58O6
Canonical SMILES
CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
InChI
InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-9,11,20-24,26-33,36-39H,7,10,12-19H2,1-6H3/b9-8+/t21-,22-,23+,24+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1
InChIKey
ITYGLICZKGWOPA-FDZHQVDOSA-N
Boiling Point
673.6±55.0°C at 760 mmHg
Solubility
Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate