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Benzoic acid, 4-[[2-(acetyloxy)-4-methoxy-6-methylbenzoyl]oxy]-2-hydroxy-6-methyl-, 3-hydroxy-4-(methoxycarbonyl)-5-methylphenyl ester
SpectraBase Compound ID 6IuAxMkQdGR
InChI InChI=1S/C28H26O11/c1-13-8-18(10-20(30)23(13)26(32)36-6)38-27(33)24-14(2)9-19(11-21(24)31)39-28(34)25-15(3)7-17(35-5)12-22(25)37-16(4)29/h7-12,30-31H,1-6H3
InChIKey BUCICDCMTFJVJR-UHFFFAOYSA-N
Mol Weight 538.51 g/mol
Molecular Formula C28H26O11
Exact Mass 538.147512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9T6ztScVho2
Name Benzoic acid, 4-[[2-(acetyloxy)-4-methoxy-6-methylbenzoyl]oxy]-2-hydroxy-6-methyl-, 3-hydroxy-4-(methoxycarbonyl)-5-methylphenyl ester
CAS Registry Number 61035-69-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26O11
InChI InChI=1S/C28H26O11/c1-13-8-18(10-20(30)23(13)26(32)36-6)38-27(33)24-14(2)9-19(11-21(24)31)39-28(34)25-15(3)7-17(35-5)12-22(25)37-16(4)29/h7-12,30-31H,1-6H3
InChIKey BUCICDCMTFJVJR-UHFFFAOYSA-N
Molecular Weight 538.505 g/mol
SMILES Oc1cc(cc(c1C(Oc1cc(c(c(c1)C)C(=O)OC)O)=O)C)OC(c1c(cc(cc1C)OC)OC(=O)C)=O
SPLASH splash10-014i-9200000000-76267e3fdff90a56c531
Source of Spectrum B-29-1150-0
Synonyms 2-O-Acetyltenuiorin 3-Hydroxy-4-{[3-hydroxy-4-(methoxycarbonyl)-5-methylphenoxy]carbonyl}-5-methylphenyl 2-(acetyloxy)-4-methoxy-6-methylbenzoate
Wiley ID 1404306