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

56T

Summary
Name:2-(furan-2-yl)ethanamine
Formula:C6 H9 N O
Formal charge:0
Formula weight:111.142 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-(furan-2-yl)ethanamine
OpenEye OEToolkits1.9.22-(furan-2-yl)ethanamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1c(CCN)occ1
InChIInChI1.03InChI=1S/C6H9NO/c7-4-3-6-2-1-5-8-6/h1-2,5H,3-4,7H2
InChIKeyInChI1.03ZQSLNSHMUQXSQJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCCc1occc1
SMILESCACTVS3.385NCCc1occc1
SMILES_CANONICALOpenEye OEToolkits1.9.2c1cc(oc1)CCN
SMILESOpenEye OEToolkits1.9.2c1cc(oc1)CCN

225946

PDB entries from 2024-10-09

PDB statisticsPDBj update infoContact PDBjnumon