Acetamide, N-[2-[3,4-dihydroxy-.alpha.-[(N-methylacetamido)methyl]benzyl]-.beta.,4,5-trihydroxyphenethyl]-N-methyl-, pentaacetate (ester)

SpectraBase Compound ID	1crJ5ivkgUq
InChI	InChI=1S/C32H38N2O12/c1-17(35)33(8)15-27(24-10-11-28(42-19(3)37)29(12-24)43-20(4)38)25-13-30(44-21(5)39)31(45-22(6)40)14-26(25)32(46-23(7)41)16-34(9)18(2)36/h10-14,27,32H,15-16H2,1-9H3
InChIKey	HRZKQBHPGXGNGV-UHFFFAOYSA-N Google Search
Mol Weight	642.7 g/mol
Molecular Formula	C32H38N2O12
Exact Mass	642.242475 g/mol

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SpectraBase Spectrum ID	YHMLmMlCeA
Name	Acetamide, N-[2-[3,4-dihydroxy-.alpha.-[(N-methylacetamido)methyl]benzyl]-.beta.,4,5-trihydroxyphenethyl]-N-methyl-, pentaacetate (ester)
Alternate Name(s)	4-(2-[Acetyl(methyl)amino]-1-[2-[2-[acetyl(methyl)amino]-1-(acetyloxy)ethyl]-4,5-bis(acetyloxy)phenyl]ethyl)-2-(acetyloxy)phenyl acetate Heptaacetyladrepine Acetic acid [4-[2-[acetyl(methyl)amino]-1-[2-[2-[acetyl(methyl)amino]-1-acetyloxyethyl]-4,5-diacetyloxyphenyl]ethyl]-2-acetyloxyphenyl] ester [4-[2-[acetyl(methyl)amino]-1-[2-[2-[acetyl(methyl)amino]-1-acetyloxyethyl]-4,5-diacetyloxyphenyl]ethyl]-2-acetyloxyphenyl] acetate [2-acetoxy-4-[2-[acetyl(methyl)amino]-1-[4,5-diacetoxy-2-[1-acetoxy-2-[acetyl(methyl)amino]ethyl]phenyl]ethyl]phenyl] acetate [2-acetyloxy-4-[1-[4,5-diacetyloxy-2-[1-acetyloxy-2-[ethanoyl(methyl)amino]ethyl]phenyl]-2-[ethanoyl(methyl)amino]ethyl]phenyl] ethanoate
CAS Registry Number	28177-12-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C32H38N2O12
InChI	InChI=1S/C32H38N2O12/c1-17(35)33(8)15-27(24-10-11-28(42-19(3)37)29(12-24)43-20(4)38)25-13-30(44-21(5)39)31(45-22(6)40)14-26(25)32(46-23(7)41)16-34(9)18(2)36/h10-14,27,32H,15-16H2,1-9H3
InChIKey	HRZKQBHPGXGNGV-UHFFFAOYSA-N
Molecular Weight	642.658 g/mol
SMILES	CC(N(C)CC(c1ccc(c(c1)OC(C)=O)OC(C)=O)c1cc(c(cc1C(CN(C)C(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)=O
SPLASH	splash10-0006-9111100000-9f6833fd5f934ec6bb53
Source of Spectrum	I-48-1852-1
Wiley ID	65764