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3,5,7-TRIHYDROXY-2'-METHOXY-6,6-DIMETHYL-PYRANYL-[3',4'-A]-FLAVANONOL
SpectraBase Compound ID 3EC7vb4MU2x
InChI InChI=1S/C21H20O7/c1-21(2)7-6-11-14(28-21)5-4-12(19(11)26-3)20-18(25)17(24)16-13(23)8-10(22)9-15(16)27-20/h4-9,18,20,22-23,25H,1-3H3
InChIKey IAJCTOOANYGADU-UHFFFAOYSA-N
Mol Weight 384.38 g/mol
Molecular Formula C21H20O7
Exact Mass 384.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ks3fkf08pZf
Name [2,6'-Bi-2H-1-benzopyran]-4(3H)-one, 3,5,7-trihydroxy-5'-methoxy-2',2'-dimethyl-, (2S-trans)-
CAS Registry Number 62498-98-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O7
InChI InChI=1S/C21H20O7/c1-21(2)7-6-11-14(28-21)5-4-12(19(11)26-3)20-18(25)17(24)16-13(23)8-10(22)9-15(16)27-20/h4-9,18,20,22-23,25H,1-3H3
InChIKey IAJCTOOANYGADU-UHFFFAOYSA-N
Molecular Weight 384.384 g/mol
SMILES Oc1cc(c2c(c1)OC(C(C2=O)O)c1ccc2c(C=CC(C)(C)O2)c1OC)O
SPLASH splash10-014i-0291000000-87728c9afb4372b729d7
Source of Spectrum W5-32751-0-0
Synonyms 2-(5-Methoxy-2,2-dimethyl-chromen-6-yl)-3,5,7-tris(oxidanyl)-2,3-dihydrochromen-4-one 3,5,7-trihydroxy-2-(5-methoxy-2,2-dimethyl-1-benzopyran-6-yl)-3,4-dihydro-2H-1-benzopyran-4-one 3,5,7-trihydroxy-2-(5-methoxy-2,2-dimethyl-chromen-6-yl)chroman-4-one 3,5,7-trihydroxy-2-(5-methoxy-2,2-dimethylchromen-6-yl)-2,3-dihydrochromen-4-one
Wiley ID 1361502