Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

UK9

Summary
Name:7,8-bis(oxidanyl)-2-phenyl-chromen-4-one
Formula:C15 H10 O4
Formal charge:0
Formula weight:254.237 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.77,8-bis(oxidanyl)-2-phenyl-chromen-4-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C15H10O4/c16-11-7-6-10-12(17)8-13(19-15(10)14(11)18)9-4-2-1-3-5-9/h1-8,16,18H
InChIKeyInChI1.06COCYGNDCWFKTMF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc2C(=O)C=C(Oc2c1O)c3ccccc3
SMILESCACTVS3.385Oc1ccc2C(=O)C=C(Oc2c1O)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)C2=CC(=O)c3ccc(c(c3O2)O)O
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)C2=CC(=O)c3ccc(c(c3O2)O)O

222415

PDB entries from 2024-07-10

PDB statisticsPDBj update infoContact PDBjnumon