140

N-PALMITOYLGLYCINE

Created:	2001-08-09
Last modified:	2021-03-01

Find Related PDB Entry
8 entries where 140 is found as a standalone ligand

Help Find related ligands:
Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Help

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	57
Chiral Atom Count	0
Bond Count	56
Aromatic Bond Count	0

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	N-PALMITOYLGLYCINE
Synonyms	N-HEXADECANOYLGLYCINE
Systematic Name (OpenEye OEToolkits)	2-(hexadecanoylamino)ethanoic acid
Formula	C₁₈ H₃₅ N O₃
Molecular Weight	313.475
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(NCC(=O)O)CCCCCCCCCCCCCCC
SMILES	CACTVS	3.341	CCCCCCCCCCCCCCCC(=O)NCC(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCCCCCC(=O)NCC(=O)O
Canonical SMILES	CACTVS	3.341	CCCCCCCCCCCCCCCC(=O)NCC(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCCCCCC(=O)NCC(=O)O
InChI	InChI	1.03	InChI=1S/C18H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(21)22/h2-16H2,1H3,(H,19,20)(H,21,22)
InChIKey	InChI	1.03	KVTFEOAKFFQCCX-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB03440
Name	N-hexadecanoylglycine
Groups	experimental
Synonyms	2-(Hexadecanoylamino)acetic acid N-hexadecanoylglycine N-Palmitoylglycine N-(1-Oxohexadecyl)glycine Elmiric acid N-ethanoyl-hexadecanamide N-Palmitoyl glycine
Categories	Amino Acids Amino Acids, Peptides, and Proteins Fatty Acids Lipids
CAS number	2441-41-0

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Bifunctional P-450/NADPH-P450 reductase	MTIKEMPQPKTFGELKNLPLLNTDKPVQALMKIADELGEIFKFEAPGRVT...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682