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(+)-Catechin-7-O-.beta.,D-apiofuranoside
SpectraBase Compound ID CBFecVVmWa7
InChI InChI=1S/C20H22O10/c21-7-20(27)8-28-19(18(20)26)29-10-4-13(23)11-6-15(25)17(30-16(11)5-10)9-1-2-12(22)14(24)3-9/h1-5,15,17-19,21-27H,6-8H2/t15-,17+,18?,19?,20?/m0/s1
InChIKey OZEIRJMOKXRLCR-IOZSCNHVSA-N
Mol Weight 422.39 g/mol
Molecular Formula C20H22O10
Exact Mass 422.121297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzpFI0dUBtq
Name (+)-Catechin-7-O-.beta.,D-apiofuranoside
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O10
InChI InChI=1S/C20H22O10/c21-7-20(27)8-28-19(18(20)26)29-10-4-13(23)11-6-15(25)17(30-16(11)5-10)9-1-2-12(22)14(24)3-9/h1-5,15,17-19,21-27H,6-8H2/t15-,17+,18?,19?,20?/m0/s1
InChIKey OZEIRJMOKXRLCR-IOZSCNHVSA-N
Molecular Weight 422.386 g/mol
SMILES Oc1c2C[C@@]([C@](Oc2cc(OC2C(C(CO2)(O)CO)O)c1)(c1cc(O)c(cc1)O)[H])(O)[H]
SPLASH splash10-0f79-0910000000-5d866e3d7a0a9020bcef
Source of Spectrum QB-17-103-1
Synonyms (2R,3S)-7-{[3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]oxy}-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5-diol
Wiley ID 841581