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kievitone hydrate

Properties

Image

Occurences in reactions

MNX_ID

MNXM4630

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₂₀H₂₂O₇

charge

mass

374.13655

reference

InChIKey

QISUKJAAXYVLMA-UHFFFAOYSA-N

InChI

InChI=1S/C20H22O7/c1-20(2,26)6-5-12-15(23)8-16(24)17-18(25)13(9-27-19(12)17)11-4-3-10(21)7-14(11)22/h3-4,7-8,13,21-24,26H,5-6,9H2,1-2H3

SMILES

CC(C)(O)CCc1c(O)cc(O)c2c1OCC(c1ccc(O)cc1O)C2=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17529 chebi:17529	kievitone hydrate 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydro-4H-chromen-4-one Kievitone hydrate
kegg.compound:C02549 keggC:C02549	Kievitone hydrate
hmdb:HMDB0038111	Kievitone hydrate 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-3,4-dihydro-2H-1-benzopyran-4-one Kievitone hydric acid kievitone hydrate
seed.compound:cpd01673 seedM:cpd01673	Kievitone hydrate kievitone hydrate
metacyc.compound:CPD-34 metacycM:CPD-34	kievitone hydrate
hmdb:HMDB38111 chebi:14494 chebi:24985 chebi:6136 keggC:M_C02549 seedM:M_cpd01673	secondary/obsolete/fantasy identifier