ISOESCIN-IB;#13;21-O-ANGELOYL-28-O-ACETYL-PROTOAESCIGENIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSIDURONIC-ACID

SpectraBase Compound ID	zgbe5CRuMS
InChI	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-HBXNSROFSA-N Google Search
Mol Weight	1131.3 g/mol
Molecular Formula	C55H86O24
Exact Mass	1130.550904 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	98oFf4HkIjA
Name	ISOESCIN-IB;#13;21-O-ANGELOYL-28-O-ACETYL-PROTOAESCIGENIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSIDURONIC-ACID
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C55H86O24
InChI	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-HBXNSROFSA-N
Literature Reference Author	M.YOSHIKAWA,T.MURAKAMI,J.YAMAHARA,H.MATSUDA
Literature Reference Citation	CHEM.PHARM.BULL.,46,1764(1998)
Literature Reference DOI	10.1248/cpb.46.1764
Molecular Weight	1131.273 g/mol
Solvent	C5D5N
Source File Reference	UWMS20855