Sitoindoside II

Catalog NumberBL-M001350
CAS Number53657-29-7
DescriptionSitoindoside-II is an acyl steryl glycoside present in M. paradisiaca (banana) fruits. It is also isolated from the chicory plant, Cichorium intybus L. Sitoindoside II is used in pharmacological studies to determine inhibitory effects on proliferation of various cancer cell lines.
IUPAC Name[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-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]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl (Z)-octadec-9-enoate
Synonyms6-O-oleoyl-sitosteryl-ß-D-glucose; 3-O-[(6'-O-oleoyl)-β-D-glucopyranosyl] sitosterol; 18:1 sitosteryl glucose
Molecular Weight841.29
Molecular FormulaC53H92O7
Purity>99%
AppearancePowder
Shelf Life1 Year
StorageStore at -20°C
Percent CompositionC 75.67%, H 11.02%, O 13.31%
Canonical SMILESCCCCCCCCC=CCCCCCCCC(=O)OCC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(C4CC=C3C2)CCC5C(C)CCC(CC)C(C)C)C)C)O)O)O
InChIInChI=1S/C53H92O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-47(54)58-36-46-48(55)49(56)50(57)51(60-46)59-41-31-33-52(6)40(35-41)27-28-42-44-30-29-43(53(44,7)34-32-45(42)52)38(5)25-26-39(9-2)37(3)4/h16-17,27,37-39,41-46,48-51,55-57H,8-15,18-26,28-36H2,1-7H3/b17-16-/t38-,39+,41+,42+,43-,44+,45+,46-,48-,49+,50-,51-,52+,53-/m1/s1
InChI KeyMEEONOMPSMYAQO-JXJRCNQOSA-N

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