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IRYANTHERIN-L;(1''S*,2''S*,R*)-3'-(1'',4''-DI-4-HYDROXYPHENYL-2'',3''-DIMETHYLBUTYL)-2',4'-DIHYDROXY-4',6'-DIMETHOXYDIHYDROCHALCONE
SpectraBase Compound ID 2gKxor40SfZ
InChI InChI=1S/C35H38O7/c1-21(19-24-5-12-26(36)13-6-24)22(2)32(25-10-14-27(37)15-11-25)34-30(39)20-31(42-4)33(35(34)40)29(38)18-9-23-7-16-28(41-3)17-8-23/h5-8,10-17,20-22,32,36-37,39-40H,9,18-19H2,1-4H3/t21-,22+,32+/m1/s1
InChIKey YMKNHLSWQAAXRA-WPLOMWCUSA-N
Mol Weight 570.7 g/mol
Molecular Formula C35H38O7
Exact Mass 570.261754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASsDn4sUxxI
Name Iryantherin L
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H38O7
InChI InChI=1S/C35H38O7/c1-21(19-24-5-12-26(36)13-6-24)22(2)32(25-10-14-27(37)15-11-25)34-30(39)20-31(42-4)33(35(34)40)29(38)18-9-23-7-16-28(41-3)17-8-23/h5-8,10-17,20-22,32,36-37,39-40H,9,18-19H2,1-4H3/t21-,22+,32+/m1/s1
InChIKey YMKNHLSWQAAXRA-WPLOMWCUSA-N
Molecular Weight 570.682 g/mol
SMILES Oc1cc(c(c(c1[C@](c1ccc(cc1)O)([C@]([C@@](Cc1ccc(cc1)O)(C)[H])(C)[H])[H])O)C(=O)CCc1ccc(cc1)OC)OC
SPLASH splash10-0a4i-0900500000-c8970cd91d642e3d1d64
Source of Spectrum G4-62-1478-4
Synonyms 1-[3-[(1S,2S,3R)-1,4-bis(4-hydroxyphenyl)-2,3-dimethyl-butyl]-2,4-dihydroxy-6-methoxy-phenyl]-3-(4-methoxyphenyl)propan-1-one 1-[3-[(1S,2S,3R)-1,4-bis(4-hydroxyphenyl)-2,3-dimethyl-butyl]-6-methoxy-2,4-bis(oxidanyl)phenyl]-3-(4-methoxyphenyl)propan-1-one 1-[3-[(1S,2S,3R)-1,4-bis(4-hydroxyphenyl)-2,3-dimethylbutyl]-2,4-dihydroxy-6-methoxyphenyl]-3-(4-methoxyphenyl)-1-propanone
Wiley ID 1608096