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(epi)gallocatechin
SpectraBase Compound ID 3XM9E7XsBqK
InChI InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1
InChIKey XMOCLSLCDHWDHP-IUODEOHRSA-N
Mol Weight 306.27 g/mol
Molecular Formula C15H14O7
Exact Mass 306.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GB1gMMvqvgg
Name (-)-Epigallocatechin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O7
InChI InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1
InChIKey XMOCLSLCDHWDHP-IUODEOHRSA-N
Molecular Weight 306.270 g/mol
SMILES Oc1cc(cc2c1C[C@]([C@](O2)(c1cc(O)c(c(c1)O)O)[H])(O)[H])O
SPLASH splash10-000i-0901000000-b5c718c3892c5b5ff199
Source of Spectrum QA-42-81-4
Synonyms (2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol (2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol (2R,3R)-2-(3,4,5-trihydroxyphenyl)chroman-3,5,7-triol (2R,3R)-2-(3,4,5-trihydroxyphenyl)chromane-3,5,7-triol (2R,3R)-2-[3,4,5-tris(oxidanyl)phenyl]-3,4-dihydro-2H-chromene-3,5,7-triol
Wiley ID 862035