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(8S)-8-(3,4-dihydroxyphenyl)-5-hydroxy-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)-8-(3,4-dihydroxyphenyl)-5-hydroxy-2-(4-hydroxy-4-methylpentyl)-2-methyl-3,4,7,8-tetrahydro-2H,6H-pyrano[3,2-g]chromen-6-one
SpectraBase Compound ID EpQBqt01kfz
InChI InChI=1S/C25H30O7/c1-24(2,30)8-4-9-25(3)10-7-15-20(32-25)13-21-22(23(15)29)18(28)12-19(31-21)14-5-6-16(26)17(27)11-14/h5-6,11,13,19,26-27,29-30H,4,7-10,12H2,1-3H3/t19-,25?/m0/s1
InChIKey CMJDNOOYGNOVCM-UBDBMELISA-N
Mol Weight 442.51 g/mol
Molecular Formula C25H30O7
Exact Mass 442.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mWev2bVhS0
Name (8S)-8-(3,4-dihydroxyphenyl)-5-hydroxy-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 C25H30O7
InChI InChI=1S/C25H30O7/c1-24(2,30)8-4-9-25(3)10-7-15-20(32-25)13-21-22(23(15)29)18(28)12-19(31-21)14-5-6-16(26)17(27)11-14/h5-6,11,13,19,26-27,29-30H,4,7-10,12H2,1-3H3/t19-,25?/m0/s1
InChIKey CMJDNOOYGNOVCM-UBDBMELISA-N
Molecular Weight 442.508 g/mol
SMILES Oc1c(ccc([C@@]2(CC(c3c(cc4OC(CCCC(C)(C)O)(CCc4c3O)C)O2)=O)[H])c1)O
SPLASH splash10-014r-2944100000-64f4d982b618853f5a1d
Source of Spectrum Jung Keun Cho, et al. Bioorganic & Medicinal Chemistry, V.21, 2013, P.3051-3057
Wiley ID 1816873