CCL

N~6~-[(CYCLOPENTYLOXY)CARBONYL]-D-LYSINE

Created: 2007-06-08
Last modified:  2011-06-04

Find related ligands:

Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count1
Bond Count40
Aromatic Bond Count0
2D diagram of CCL

Chemical Component Summary

NameN~6~-[(CYCLOPENTYLOXY)CARBONYL]-D-LYSINE
Systematic Name (OpenEye OEToolkits)(2R)-2-amino-6-(cyclopentyloxycarbonylamino)hexanoic acid
FormulaC12 H22 N2 O4
Molecular Weight258.314
TypeD-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(OC1CCCC1)NCCCCC(C(=O)O)N
SMILESCACTVS3.341N[CH](CCCCNC(=O)OC1CCCC1)C(O)=O
SMILESOpenEye OEToolkits1.5.0C1CCC(C1)OC(=O)NCCCCC(C(=O)O)N
Canonical SMILESCACTVS3.341 N[C@H](CCCCNC(=O)OC1CCCC1)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 C1CCC(C1)OC(=O)NCCCC[C@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C12H22N2O4/c13-10(11(15)16)7-3-4-8-14-12(17)18-9-5-1-2-6-9/h9-10H,1-8,13H2,(H,14,17)(H,15,16)/t10-/m1/s1
InChIKeyInChI1.03 ZHGGYCNHXLZKHG-SNVBAGLBSA-N

Related Resource References

Resource NameReference
PubChem 16741243