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3,3,",4',4''',5,5",7,7''-Octahydroxy-3',3'"-biflavone
SpectraBase Compound ID K8vJi3TPr06
InChI InChI=1S/C30H18O12/c31-13-7-19(35)23-21(9-13)41-29(27(39)25(23)37)11-1-3-17(33)15(5-11)16-6-12(2-4-18(16)34)30-28(40)26(38)24-20(36)8-14(32)10-22(24)42-30/h1-10,31-36,39-40H
InChIKey IXCLTWQBCMHOFP-UHFFFAOYSA-N
Mol Weight 570.46 g/mol
Molecular Formula C30H18O12
Exact Mass 570.079826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YkBrgOSgbr
Name 3,3,",4',4''',5,5",7,7''-Octahydroxy-3',3'"-biflavone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H18O12
InChI InChI=1S/C30H18O12/c31-13-7-19(35)23-21(9-13)41-29(27(39)25(23)37)11-1-3-17(33)15(5-11)16-6-12(2-4-18(16)34)30-28(40)26(38)24-20(36)8-14(32)10-22(24)42-30/h1-10,31-36,39-40H
InChIKey IXCLTWQBCMHOFP-UHFFFAOYSA-N
Molecular Weight 570.462 g/mol
SMILES Oc1cc2c(C(C(=C(c3ccc(c(c3)-c3cc(C4=C(C(=O)c5c(O4)cc(cc5O)O)O)ccc3O)O)O2)O)=O)c(c1)O
SPLASH splash10-0gi3-0500190000-920fe23c52f4b8949cd8
Source of Spectrum F4-42-2783-15
Synonyms 3,5,7-trihydroxy-2-[4-hydroxy-3-[2-hydroxy-5-(3,5,7-trihydroxy-4-oxo-1-benzopyran-2-yl)phenyl]phenyl]-1-benzopyran-4-one 3,5,7-trihydroxy-2-[4-hydroxy-3-[2-hydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)phenyl]phenyl]chromen-4-one 3,5,7-trihydroxy-2-[4-hydroxy-3-[2-hydroxy-5-(3,5,7-trihydroxy-4-oxo-chromen-2-yl)phenyl]phenyl]chromen-4-one 3,5,7-tris(oxidanyl)-2-[4-oxidanyl-3-[2-oxidanyl-5-[3,5,7-tris(oxidanyl)-4-oxidanylidene-chromen-2-yl]phenyl]phenyl]chromen-4-one
Wiley ID 1673852