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2-(3,5-dihydroxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-3-methoxy-5-methylbenzoic acid
SpectraBase Compound ID LmSkcbRkN09
InChI InChI=1S/C19H14O7/c1-8-6-10(19(24)25)14(12(7-8)26-2)15-16(21)9-4-3-5-11(20)13(9)17(22)18(15)23/h3-7,20,23H,1-2H3,(H,24,25)
InChIKey PBKZJIMGHNPKBJ-UHFFFAOYSA-N
Mol Weight 354.31 g/mol
Molecular Formula C19H14O7
Exact Mass 354.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQdZbYunri3
Name 2-(3,5-dihydroxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-3-methoxy-5-methylbenzoic acid
Alternate Name(s) 2-(1,4-Dihydro-3,5-dihydroxy-1,4-dioxo-2-naphthalenyl)-3-methoxy-5-methylbenzoic acid(Antibiotic WS-5995C)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14O7
InChI InChI=1S/C19H14O7/c1-8-6-10(19(24)25)14(12(7-8)26-2)15-16(21)9-4-3-5-11(20)13(9)17(22)18(15)23/h3-7,20,23H,1-2H3,(H,24,25)
InChIKey PBKZJIMGHNPKBJ-UHFFFAOYSA-N
Molecular Weight 354.314 g/mol
SMILES Oc1cccc2c1C(C(=C(c1c(C(=O)O)cc(cc1OC)C)C2=O)O)=O
SPLASH splash10-0pdi-0019000000-3c923905b20451ecea6b
Source of Spectrum J-59-6081-7
Wiley ID 1344473