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3,4-Flavandiol, 3',4',7-trimethoxy-, 3-acetate, trans-2,3,cis-2,4-(+)-
SpectraBase Compound ID DhnkMaC0Ul8
InChI InChI=1S/C20H22O7/c1-11(21)26-20-18(22)14-7-6-13(23-2)10-16(14)27-19(20)12-5-8-15(24-3)17(9-12)25-4/h5-10,18-20,22H,1-4H3
InChIKey WVXJEZMPKRCVSK-UHFFFAOYSA-N
Mol Weight 374.39 g/mol
Molecular Formula C20H22O7
Exact Mass 374.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgNlleZWsWW
Name 3,4-Flavandiol, 3',4',7-trimethoxy-, 3-acetate, trans-2,3,cis-2,4-(+)-
CAS Registry Number 29799-49-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O7
InChI InChI=1S/C20H22O7/c1-11(21)26-20-18(22)14-7-6-13(23-2)10-16(14)27-19(20)12-5-8-15(24-3)17(9-12)25-4/h5-10,18-20,22H,1-4H3
InChIKey WVXJEZMPKRCVSK-UHFFFAOYSA-N
Molecular Weight 374.389 g/mol
SMILES OC1c2ccc(cc2OC(c2ccc(c(c2)OC)OC)C1OC(C)=O)OC
SPLASH splash10-001i-0942000000-e30962ff0a5b5e960424
Source of Spectrum EP-2121-0-0
Synonyms 2-(3,4-Dimethoxyphenyl)-4-hydroxy-7-methoxy-3,4-dihydro-2H-chromen-3-yl acetate 3,4-Flavandiol, 3',4',7-trimethoxy-, 3-acetate, (2R,3S,4R)-(+)- Acetic acid [2-(3,4-dimethoxyphenyl)-4-hydroxy-7-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl] ester [2-(3,4-dimethoxyphenyl)-4-hydroxy-7-methoxy-3,4-dihydro-2H-chromen-3-yl] acetate [2-(3,4-dimethoxyphenyl)-4-hydroxy-7-methoxy-chroman-3-yl] acetate [2-(3,4-dimethoxyphenyl)-7-methoxy-4-oxidanyl-3,4-dihydro-2H-chromen-3-yl] ethanoate
Wiley ID 1356578