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5-[3-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-2-yl]pentanoic acid
SpectraBase Compound ID 5DsH7qRSdBx
InChI InChI=1S/C20H18O7/c21-12-7-5-11(6-8-12)18-15(3-1-2-4-17(24)25)27-16-10-13(22)9-14(23)19(16)20(18)26/h5-10,21-23H,1-4H2,(H,24,25)
InChIKey GWBKNTHTUDQPRZ-UHFFFAOYSA-N
Mol Weight 370.36 g/mol
Molecular Formula C20H18O7
Exact Mass 370.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtMWacYeeS3
Name 5-[3-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-2-yl]pentanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O7
InChI InChI=1S/C20H18O7/c21-12-7-5-11(6-8-12)18-15(3-1-2-4-17(24)25)27-16-10-13(22)9-14(23)19(16)20(18)26/h5-10,21-23H,1-4H2,(H,24,25)
InChIKey GWBKNTHTUDQPRZ-UHFFFAOYSA-N
Molecular Weight 370.357 g/mol
SMILES Oc1cc(cc2c1C(C(c1ccc(cc1)O)=C(O2)CCCCC(=O)O)=O)O
SPLASH splash10-006t-0189000000-d4f5c8423d8ccc1cf05a
Source of Spectrum SO-20-415-3
Synonyms 5-[5,7-dihydroxy-3-(4-hydroxyphenyl)-4-keto-chromen-2-yl]valeric acid 5-[5,7-dihydroxy-3-(4-hydroxyphenyl)-4-oxo-1-benzopyran-2-yl]pentanoic acid 5-[5,7-dihydroxy-3-(4-hydroxyphenyl)-4-oxo-chromen-2-yl]pentanoic acid
Wiley ID 877533