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

VCB

Summary
Name:(2~{R})-2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]-2-phenyl-ethanoic acid
Formula:C22 H15 N O4
Formal charge:0
Formula weight:357.359 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{R})-2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]-2-phenyl-ethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C22H15NO4/c24-20-15-10-5-4-9-14(15)18-16(20)11-6-12-17(18)21(25)23-19(22(26)27)13-7-2-1-3-8-13/h1-12,19H,(H,23,25)(H,26,27)/t19-/m1/s1
InChIKeyInChI1.03JJNHPDOJBUAQDZ-LJQANCHMSA-N
SMILES_CANONICALCACTVS3.385OC(=O)[C@H](NC(=O)c1cccc2C(=O)c3ccccc3c12)c4ccccc4
SMILESCACTVS3.385OC(=O)[CH](NC(=O)c1cccc2C(=O)c3ccccc3c12)c4ccccc4
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)[C@H](C(=O)O)NC(=O)c2cccc3c2-c4ccccc4C3=O
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)C(C(=O)O)NC(=O)c2cccc3c2-c4ccccc4C3=O

222415

PDB entries from 2024-07-10

PDB statisticsPDBj update infoContact PDBjnumon