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7H-Pyrano[2,3-f]-1,4-benzodioxin-7-one, 8-(3,4-dimethoxyphenyl)-2,3-dihydro-2-(hydroxymethyl)-3-(3,4,5-trimethoxyphenyl)-, trans-(.+-.)-

View entire compound with spectra: 1 MS (GC)

7H-Pyrano[2,3-f]-1,4-benzodioxin-7-one, 8-(3,4-dimethoxyphenyl)-2,3-dihydro-2-(hydroxymethyl)-3-(3,4,5-trimethoxyphenyl)-, trans-(.+-.)-
SpectraBase Compound ID DgpjYs0huV2
InChI InChI=1S/C29H28O10/c1-32-19-8-6-15(10-21(19)33-2)18-14-37-27-17(25(18)31)7-9-20-29(27)39-24(13-30)26(38-20)16-11-22(34-3)28(36-5)23(12-16)35-4/h6-12,14,24,26,30H,13H2,1-5H3/t24-,26-/m1/s1
InChIKey WOMOKPNDJCISRF-AOYPEHQESA-N
Mol Weight 536.53 g/mol
Molecular Formula C29H28O10
Exact Mass 536.168247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XftLK0YaZg
Name 7H-Pyrano[2,3-f]-1,4-benzodioxin-7-one, 8-(3,4-dimethoxyphenyl)-2,3-dihydro-2-(hydroxymethyl)-3-(3,4,5-trimethoxyphenyl)-, trans-(.+-.)-
CAS Registry Number 116718-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H28O10
InChI InChI=1S/C29H28O10/c1-32-19-8-6-15(10-21(19)33-2)18-14-37-27-17(25(18)31)7-9-20-29(27)39-24(13-30)26(38-20)16-11-22(34-3)28(36-5)23(12-16)35-4/h6-12,14,24,26,30H,13H2,1-5H3/t24-,26-/m1/s1
InChIKey WOMOKPNDJCISRF-AOYPEHQESA-N
Molecular Weight 536.533 g/mol
SMILES OC[C@]1(Oc2c3OC=C(C(c3ccc2O[C@@]1(c1cc(OC)c(c(c1)OC)OC)[H])=O)c1cc(OC)c(cc1)OC)[H]
SPLASH splash10-00dr-0790080000-10172a65acd70d4f3ad6
Source of Spectrum KC-1988-1240-8
Synonyms (2R,3R)-8-(3,4-dimethoxyphenyl)-2-(hydroxymethyl)-3-(3,4,5-trimethoxyphenyl)-2,3-dihydro-7H-[1,4]dioxino[2,3-h]chromen-7-one 3',4''-di-O-methylxanthocercin A
Wiley ID 1404073