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

E1P

Summary
Name:ETHYL OXO(PIPERIDIN-1-YL)ACETATE
Formula:C9 H15 N O3
Formal charge:0
Formula weight:185.22 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04ethyl oxo(piperidin-1-yl)acetate
OpenEye OEToolkits1.5.0ethyl 2-oxo-2-piperidin-1-yl-ethanoate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(C(=O)OCC)N1CCCCC1
SMILES_CANONICALCACTVS3.341CCOC(=O)C(=O)N1CCCCC1
SMILESCACTVS3.341CCOC(=O)C(=O)N1CCCCC1
SMILES_CANONICALOpenEye OEToolkits1.5.0CCOC(=O)C(=O)N1CCCCC1
SMILESOpenEye OEToolkits1.5.0CCOC(=O)C(=O)N1CCCCC1
InChIInChI1.03InChI=1S/C9H15NO3/c1-2-13-9(12)8(11)10-6-4-3-5-7-10/h2-7H2,1H3
InChIKeyInChI1.03ASBDXHCMVYVJQQ-UHFFFAOYSA-N

222926

건을2024-07-24부터공개중

PDB statisticsPDBj update infoContact PDBjnumon