(S,S)-N,N'-Bis(1-(hydroxymethyl)benzyl]anthraquinone-1,8-dicarboxamide

SpectraBase Compound ID	ATLqZyknjWf
InChI	InChI=1S/C34H30N2O6/c37-19-23(17-21-9-3-1-4-10-21)35-33(41)27-15-7-13-25-29(27)32(40)30-26(31(25)39)14-8-16-28(30)34(42)36-24(20-38)18-22-11-5-2-6-12-22/h1-16,23-24,37-38H,17-20H2,(H,35,41)(H,36,42)/t23-,24-/m0/s1
InChIKey	DBZFWCZBFUTXRN-ZEQRLZLVSA-N Google Search
Mol Weight	562.6 g/mol
Molecular Formula	C34H30N2O6
Exact Mass	562.210387 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	6Mkb9SOESvS
Name	(S,S)-N,N'-Bis(1-(hydroxymethyl)benzyl]anthraquinone-1,8-dicarboxamide
Alternate Name(s)	N(1),N(8)-bis[(1S)-1-benzyl-2-hydroxyethyl]-9,10-dioxo-9,10-dihydro-1,8-anthracenedicarboxamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C34H30N2O6
InChI	InChI=1S/C34H30N2O6/c37-19-23(17-21-9-3-1-4-10-21)35-33(41)27-15-7-13-25-29(27)32(40)30-26(31(25)39)14-8-16-28(30)34(42)36-24(20-38)18-22-11-5-2-6-12-22/h1-16,23-24,37-38H,17-20H2,(H,35,41)(H,36,42)/t23-,24-/m0/s1
InChIKey	DBZFWCZBFUTXRN-ZEQRLZLVSA-N
Molecular Weight	562.622 g/mol
SMILES	N(C(c1cccc2c1C(c1c(C(N[C@](CO)(Cc3ccccc3)[H])=O)cccc1C2=O)=O)=O)[C@](CO)(Cc1ccccc1)[H]
SPLASH	splash10-0w31-0193500000-a9b3a50d85e7427627c6
Source of Spectrum	KD-16-3729-5
Wiley ID	1638033