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O12

Summary
Name:N~5~-dodecanoyl-L-ornithine
Formula:C17 H34 N2 O3
Formal charge:0
Formula weight:314.463 Da
Component type:L-peptide linking

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N~5~-dodecanoyl-L-ornithine
OpenEye OEToolkits1.5.0(2S)-2-amino-5-(dodecanoylamino)pentanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(NCCCC(N)C(=O)O)CCCCCCCCCCC
SMILES_CANONICALCACTVS3.341CCCCCCCCCCCC(=O)NCCC[C@H](N)C(O)=O
SMILESCACTVS3.341CCCCCCCCCCCC(=O)NCCC[CH](N)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCCCCC(=O)NCCC[C@@H](C(=O)O)N
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCC(=O)NCCCC(C(=O)O)N
InChIInChI1.03InChI=1S/C17H34N2O3/c1-2-3-4-5-6-7-8-9-10-13-16(20)19-14-11-12-15(18)17(21)22/h15H,2-14,18H2,1H3,(H,19,20)(H,21,22)/t15-/m0/s1
InChIKeyInChI1.03FISWIEVEEGBZND-HNNXBMFYSA-N

227344

PDB entries from 2024-11-13

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