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3,4,8,10-tetrahydroxy-9-methoxy-5H-isochromeno[4,3-b]chromen-7-one
SpectraBase Compound ID 5bzqkN45fCN
InChI InChI=1S/C17H12O8/c1-23-16-9(19)4-10-11(13(16)21)14(22)17-15(25-10)6-2-3-8(18)12(20)7(6)5-24-17/h2-4,18-21H,5H2,1H3
InChIKey PXMLYJQOBCTZQP-UHFFFAOYSA-N
Mol Weight 344.27 g/mol
Molecular Formula C17H12O8
Exact Mass 344.053217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BreCSp2IfJi
Name 3,4,8,10-tetrahydroxy-9-methoxy-5H-isochromeno[4,3-b]chromen-7-one
Alternate Name(s) 3,4,8,10-tetrahydroxy-9-methoxy-5H-[2]benzopyrano[4,3-b][1]benzopyran-7-one 9-Methoxy-3,4,8,10-tetrakis(oxidanyl)-5H-isochromeno[4,3-b]chromen-7-one Benthamianin
CAS Registry Number 53766-41-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O8
InChI InChI=1S/C17H12O8/c1-23-16-9(19)4-10-11(13(16)21)14(22)17-15(25-10)6-2-3-8(18)12(20)7(6)5-24-17/h2-4,18-21H,5H2,1H3
InChIKey PXMLYJQOBCTZQP-UHFFFAOYSA-N
Molecular Weight 344.275 g/mol
SMILES Oc1c(c(c2c(OC3=C(OCc4c(c(ccc34)O)O)C2=O)c1)O)OC
SPLASH splash10-002f-0119000000-9e126b547603086625a4
Source of Spectrum KC-1979-2702-0
Wiley ID 1337725