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KMP

Summary
Name:3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE
Synonyms:KAEMPHEROL
Formula:C15 H10 O6
Formal charge:0
Formula weight:286.236 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
OpenEye OEToolkits1.5.03,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1c3c(OC(=C1O)c2ccc(O)cc2)cc(O)cc3O
SMILES_CANONICALCACTVS3.341Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
SMILESCACTVS3.341Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
SMILESOpenEye OEToolkits1.5.0c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
InChIInChI1.03InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
InChIKeyInChI1.03IYRMWMYZSQPJKC-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

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