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BIS-3',8-(4',5,7-TRIHYDROXY-FLAVANONE)
SpectraBase Compound ID 2T0Ov66X4wA
InChI InChI=1S/C30H22O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-10,24-25,31-36H,11-12H2
InChIKey ULTQJSQDLWNWTR-UHFFFAOYSA-N
Mol Weight 542.5 g/mol
Molecular Formula C30H22O10
Exact Mass 542.121297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbkbQ1f2EeZ
Name 4H-1-Benzopyran-4-one, 8-[5-(3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl)-2-hydroxyphenyl]-2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)- [S-(R*,R*)]-
CAS Registry Number 72149-91-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H22O10
InChI InChI=1S/C30H22O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-10,24-25,31-36H,11-12H2
InChIKey ULTQJSQDLWNWTR-UHFFFAOYSA-N
Molecular Weight 542.496 g/mol
SMILES Oc1ccc(cc1-c1c2c(c(cc1O)O)C(CC(O2)c1ccc(cc1)O)=O)C1CC(c2c(cc(cc2O1)O)O)=O
SPLASH splash10-0ar0-9720000000-1a6d1b2e2d97dba8d635
Source of Spectrum W5-1989-12142-1
Synonyms 8-[5-(5,7-dihydroxy-4-keto-chroman-2-yl)-2-hydroxy-phenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one 8-[5-(5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one 8-[5-(5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one 8-[5-(5,7-dihydroxy-4-oxo-chroman-2-yl)-2-hydroxy-phenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one 8-[5-[5,7-bis(oxidanyl)-4-oxidanylidene-2,3-dihydrochromen-2-yl]-2-oxidanyl-phenyl]-2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-2,3-dihydrochromen-4-one
Wiley ID 1404852