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MOCINTRIFOLIN_A;5-HYDROXY-2-(2-HYDROXYBENZOYL)-4-(HYDROXYMETHYL)-BENZOIC_ACID_2-HYDROXYETHYLESTER
SpectraBase Compound ID 33Ji6KCaY1G
InChI InChI=1S/C17H16O7/c18-5-6-24-17(23)13-8-15(21)10(9-19)7-12(13)16(22)11-3-1-2-4-14(11)20/h1-4,7-8,18-21H,5-6,9H2
InChIKey BRYATOWTSDMLNN-UHFFFAOYSA-N
Mol Weight 332.31 g/mol
Molecular Formula C17H16O7
Exact Mass 332.089603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KlAewkvdV3p
Name MOCINTRIFOLIN_A;5-HYDROXY-2-(2-HYDROXYBENZOYL)-4-(HYDROXYMETHYL)-BENZOIC_ACID_2-HYDROXYETHYLESTER
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16O7
InChI InChI=1S/C17H16O7/c18-5-6-24-17(23)13-8-15(21)10(9-19)7-12(13)16(22)11-3-1-2-4-14(11)20/h1-4,7-8,18-21H,5-6,9H2
InChIKey BRYATOWTSDMLNN-UHFFFAOYSA-N
Literature Reference Author Y.DENG,Y.W.CHIN,H.CHAI,W.J.KELLER,A.D.KINGHORN
Literature Reference Citation J.NAT.PROD.,70,2049(2007)
Literature Reference DOI 10.1021/np070501z
Molecular Weight 332.310 g/mol
Sample ID 31290
Solvent CD3OD