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ARISTOLOCHIC-ACID-III-A-6-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID C9xoI6Refyo
InChI InChI=1S/C22H19NO12/c24-6-14-17(25)18(26)19(27)22(35-14)34-9-2-1-8-3-12(23(30)31)15-11(21(28)29)5-13-20(33-7-32-13)16(15)10(8)4-9/h1-5,14,17-19,22,24-27H,6-7H2,(H,28,29)/t14-,17-,18+,19-,22-/m0/s1
InChIKey CQFJVMUOQSTPPK-FQDUKEJRSA-N
Mol Weight 489.39 g/mol
Molecular Formula C22H19NO12
Exact Mass 489.090725 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 76bcSgJUsv
Name ARISTOLOCHIC-ACID-III-A-6-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19NO12
InChI InChI=1S/C22H19NO12/c24-6-14-17(25)18(26)19(27)22(35-14)34-9-2-1-8-3-12(23(30)31)15-11(21(28)29)5-13-20(33-7-32-13)16(15)10(8)4-9/h1-5,14,17-19,22,24-27H,6-7H2,(H,28,29)/t14-,17-,18+,19-,22-/m0/s1
InChIKey CQFJVMUOQSTPPK-FQDUKEJRSA-N
Literature Reference Author L.HONG,Y.SAKAGAMI,S.MARUMO,C.XINMIN
Literature Reference Citation PHYTOCHEM.,37,237(1994)
Literature Reference DOI 10.1016/0031-9422(94)85032-1
Molecular Weight 489.392 g/mol
Solvent DMSO-D6
Source File Reference UWLU23075