Isoescin IB Properties, Molecular Formula, Applications - WorldOfChemicals

Isoescin IB Properties

Isoescin IB

Molecule Structure Image

Description

 

Chemical Properties

CAS Number 219944-46-4
IUPAC Name (3beta,16alpha,21beta,22alpha)-28-Acetoxy-16,22,24-trihydroxy-21-{[(2Z)-2-methyl-2-butenoyl]oxy}olean-12-en-3-yl beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->4)]-beta-D-glucopyranosiduronic acid
InChI 1S/C55H86O24/c1-10-23(2)46(71)79-44-43(68)55(22-72-24(3)59)26(17-50(44,4)5)25-11-12-30-51(6)15-14-32(52(7,21-58)29(51)13-16-53(30,8)54(25,9)18-31(55)60)75-49-41(77-48-38(66)36(64)34(62)28(20-57)74-48)39(67)40(42(78-49)45(69)70)76-47-37(65)35(63)33(61)27(19-56)73-47/h10-11,26-44,47-49,56-58,60-68H,12-22H2,1-9H3,(H,69,70)/b23-10-/t26-,27+,28+,29+,30+,31+,32-,33+,34+,35-,36-,37+,38+,39-,40-,41+,42-,43-,44-,47-,48-,49+,51-,52+,53+,54+,55-/m0/s1
InChIKey YOSIWGSGLDDTHJ-OXPBSUTMSA-N
Molar Mass 1131.26 g/mol
Molecular Formula C55H86O24
Synonyms Isoescine IB;2-Butenoic Acid, 2-Methyl-, (3beta,4beta,16alpha,21beta,22alpha)-28-(Acetyloxy)-3-[[O-beta-D-Glucopyranosyl-(1->2)-O-[beta-D-Glucopyranosyl-(1->4)]-beta-D-Glucopyranuronosyl]Oxy]-16,22,23-Trihydroxyolean-12-En-21-Yl Ester, (2Z)-
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