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(8S)-5-hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2-(4-hydroxy-4-methylpentyl)-2-methyl-3,4,7,8-tetrahydro-2H,6H-pyrano[3,2-g]chromen-6-one

View entire compound with spectra: 1 MS (GC)

(8S)-5-hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2-(4-hydroxy-4-methylpentyl)-2-methyl-3,4,7,8-tetrahydro-2H,6H-pyrano[3,2-g]chromen-6-one
SpectraBase Compound ID A9TRTAwBlM
InChI InChI=1S/C27H34O8/c1-26(2,31)8-6-9-27(3)10-7-16-19(35-27)14-20-23(24(16)29)17(28)13-18(34-20)15-11-21(32-4)25(30)22(12-15)33-5/h11-12,14,18,29-31H,6-10,13H2,1-5H3/t18-,27?/m0/s1
InChIKey DHYMKZKAVOUQFT-HSYKDVHTSA-N
Mol Weight 486.6 g/mol
Molecular Formula C27H34O8
Exact Mass 486.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fxLZZ7VvTJ
Name (8S)-5-hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2-(4-hydroxy-4-methylpentyl)-2-methyl-3,4,7,8-tetrahydro-2H,6H-pyrano[3,2-g]chromen-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O8
InChI InChI=1S/C27H34O8/c1-26(2,31)8-6-9-27(3)10-7-16-19(35-27)14-20-23(24(16)29)17(28)13-18(34-20)15-11-21(32-4)25(30)22(12-15)33-5/h11-12,14,18,29-31H,6-10,13H2,1-5H3/t18-,27?/m0/s1
InChIKey DHYMKZKAVOUQFT-HSYKDVHTSA-N
Molecular Weight 486.561 g/mol
SMILES Oc1c(cc([C@@]2(CC(c3c(cc4OC(CCCC(C)(C)O)(CCc4c3O)C)O2)=O)[H])cc1OC)OC
SPLASH splash10-014j-2829200000-e4336118fbb7a83e4e06
Source of Spectrum Jung Keun Cho, et al. Bioorganic & Medicinal Chemistry, V.21, 2013, P.3051-3057
Wiley ID 1816876