PERACETYL-HEXAGALLOLOYLGLUCOSE

SpectraBase Compound ID	2GLBPB6mPjr
InChI	InChI=1S/C82H70O47/c1-31(83)107-54-18-48(19-55(108-32(2)84)67(54)119-43(13)95)76(100)106-30-66-73(126-78(102)50-22-58(111-35(5)87)69(121-45(15)97)59(23-50)112-36(6)88)74(127-79(103)51-26-64(117-41(11)93)72(65(27-51)118-42(12)94)125-77(101)49-20-56(109-33(3)85)68(120-44(14)96)57(21-49)110-34(4)86)75(128-80(104)52-24-60(113-37(7)89)70(122-46(16)98)61(25-52)114-38(8)90)82(124-66)129-81(105)53-28-62(115-39(9)91)71(123-47(17)99)63(29-53)116-40(10)92/h18-29,66,73-75,82H,30H2,1-17H3
InChIKey	XKCPAURUTYBZPL-UHFFFAOYSA-N Google Search
Mol Weight	1807.4 g/mol
Molecular Formula	C82H70O47
Exact Mass	1806.308739 g/mol

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SpectraBase Spectrum ID	7W0BEMeTYvO
Name	PERACETYL-HEXAGALLOLOYLGLUCOSE
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C82H70O47
InChI	InChI=1S/C82H70O47/c1-31(83)107-54-18-48(19-55(108-32(2)84)67(54)119-43(13)95)76(100)106-30-66-73(126-78(102)50-22-58(111-35(5)87)69(121-45(15)97)59(23-50)112-36(6)88)74(127-79(103)51-26-64(117-41(11)93)72(65(27-51)118-42(12)94)125-77(101)49-20-56(109-33(3)85)68(120-44(14)96)57(21-49)110-34(4)86)75(128-80(104)52-24-60(113-37(7)89)70(122-46(16)98)61(25-52)114-38(8)90)82(124-66)129-81(105)53-28-62(115-39(9)91)71(123-47(17)99)63(29-53)116-40(10)92/h18-29,66,73-75,82H,30H2,1-17H3
InChIKey	XKCPAURUTYBZPL-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	1807.430 g/mol
Solvent	CDCl3
Source File Reference	UIAP1387