3-O-DIGALLOYL-1,2,4,6-TETRA-O-GALLOYL-BETA-D-GLUCOSE_(HEXAGALLOYLGLUCOSE)

SpectraBase Compound ID	BJWGCdFb1zO
InChI	InChI=1S/C48H36O30/c49-20-1-14(2-21(50)33(20)61)42(66)72-13-32-39(75-44(68)16-5-24(53)35(63)25(54)6-16)40(76-45(69)19-11-30(59)38(31(60)12-19)74-43(67)15-3-22(51)34(62)23(52)4-15)41(77-46(70)17-7-26(55)36(64)27(56)8-17)48(73-32)78-47(71)18-9-28(57)37(65)29(58)10-18/h1-12,32,39-41,48-65H,13H2
InChIKey	YOZOWEBNQFOSGC-UHFFFAOYSA-N Google Search
Mol Weight	1092.8 g/mol
Molecular Formula	C48H36O30
Exact Mass	1092.12914 g/mol

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SpectraBase Spectrum ID	BM5C87sTdef
Name	3-O-DIGALLOYL-1,2,4,6-TETRA-O-GALLOYL-BETA-D-GLUCOSE_(HEXAGALLOYLGLUCOSE)
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C48H36O30
InChI	InChI=1S/C48H36O30/c49-20-1-14(2-21(50)33(20)61)42(66)72-13-32-39(75-44(68)16-5-24(53)35(63)25(54)6-16)40(76-45(69)19-11-30(59)38(31(60)12-19)74-43(67)15-3-22(51)34(62)23(52)4-15)41(77-46(70)17-7-26(55)36(64)27(56)8-17)48(73-32)78-47(71)18-9-28(57)37(65)29(58)10-18/h1-12,32,39-41,48-65H,13H2
InChIKey	YOZOWEBNQFOSGC-UHFFFAOYSA-N
Literature Reference Author	J.K.HWANG,T.W.KONG,N.I.BAEK,Y.R.PYUN
Literature Reference Citation	PLANTA.MED.,66,273(2000)
Literature Reference DOI	10.1055/s-2000-8569
Molecular Weight	1092.796 g/mol
Solvent	CDCl3
Source File Reference	UIAP1386