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TERREMIDE-A;METHYL-3-HYDROXY-2-[2-(NICOTINAMIDO)-BENZAMIDO]-BENZOATE
SpectraBase Compound ID DwmSjzBtDJB
InChI InChI=1S/C21H17N3O5/c1-29-21(28)15-8-4-10-17(25)18(15)24-20(27)14-7-2-3-9-16(14)23-19(26)13-6-5-11-22-12-13/h2-12,25H,1H3,(H,23,26)(H,24,27)
InChIKey HGILROHNRVPEBC-UHFFFAOYSA-N
Mol Weight 391.38 g/mol
Molecular Formula C21H17N3O5
Exact Mass 391.116821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ByhwR23Qxe2
Name TERREMIDE-A;METHYL-3-HYDROXY-2-[2-(NICOTINAMIDO)-BENZAMIDO]-BENZOATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H17N3O5
InChI InChI=1S/C21H17N3O5/c1-29-21(28)15-8-4-10-17(25)18(15)24-20(27)14-7-2-3-9-16(14)23-19(26)13-6-5-11-22-12-13/h2-12,25H,1H3,(H,23,26)(H,24,27)
InChIKey HGILROHNRVPEBC-UHFFFAOYSA-N
Literature Reference Author Y.WANG,J.ZHENG,P.LIU,W.WANG,W.ZHU
Literature Reference Citation MAR.DRUGS,9,1368(2011)
Literature Reference DOI 10.3390/md9081368
Molecular Weight 391.383 g/mol
Source File Reference UWBT7011