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

8B6

Summary
Name:4-oxidanylfuro[3,2-g]chromen-7-one
Formula:C11 H6 O4
Formal charge:0
Formula weight:202.163 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-oxidanylfuro[3,2-g]chromen-7-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H
InChIKeyInChI1.03GIJHDGJRTUSBJR-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1c2ccoc2cc3OC(=O)C=Cc13
SMILESCACTVS3.385Oc1c2ccoc2cc3OC(=O)C=Cc13
SMILES_CANONICALOpenEye OEToolkits2.0.6c1coc2c1c(c3c(c2)OC(=O)C=C3)O
SMILESOpenEye OEToolkits2.0.6c1coc2c1c(c3c(c2)OC(=O)C=C3)O

218853

PDB entries from 2024-04-24

PDB statisticsPDBj update infoContact PDBjnumon