MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

N-benzyloxycarbonylglycine

	Properties	Image
MNX_ID	MNXM4725
reference	chebi:368997
formula	C₁₀H₁₀NO₄
global charge	-1
mol weight	208.193
InChIKey	CJUMAFVKTCBCJK-UHFFFAOYSA-M
InChI	InChI=1S/C10H11NO4/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)/p-1
SMILES	O=C([O-])CNC(=O)OCC1=CC=CC=C1

MNX internals

InChI (mnx)	InChI=1/C10H11NO4/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:8]([CH2:7][O:15][C:10](=[N:11][CH2:6][C:9](=[O:12])[OH:13])[OH:14])[CH:5]=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	17
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:368997 chebi:368997 CJUMAFVKTCBCJK-UHFFFAOYSA-M	N-benzyloxycarbonylglycine Cbz-glycinate N-benzyloxycarbonylglycinate N-benzyloxycarbonylglycinate anion N-benzyloxycarbonylglycinate(1-) Z-glycinate {[(benzyloxy)carbonyl]amino}acetate
sabiork.compound:29327 sabiorkM:29327 CJUMAFVKTCBCJK-UHFFFAOYSA-N	Benzyloxycarbonyl-Gly Z-Gly
kegg.compound:C03710 keggC:C03710 CJUMAFVKTCBCJK-UHFFFAOYSA-N	N-Benzyloxycarbonylglycine N-CBZ-glycine
seed.compound:cpd02327 seedM:cpd02327 CJUMAFVKTCBCJK-UHFFFAOYSA-M	N-CBZ-glycine N-Benzyloxycarbonylglycine N-benzyloxycarbonylglycine
CHEBI:16532 chebi:16532 CJUMAFVKTCBCJK-UHFFFAOYSA-N	N-benzyloxycarbonylglycine (Cbz)gly Benzyloxycarbonylglycine Carbobenzoxyglycine Carbobenzoxyl glycine Carbobenzyloxyglycine N-(benzyloxycarbonyl)glycine N-Benzyloxycarbonylglycine N-CBZ-glycine N-Carbobenzoxyglycine N-Carbobenzyloxyglycine N-Carboxyglycine N-benzyl ester Z-Gly
metacyc.compound:CPD-214 metacycM:CPD-214 CJUMAFVKTCBCJK-UHFFFAOYSA-M	N-benzyloxycarbonylglycine N-CBZ-glycine
chebi:12493 chebi:21683 chebi:7253 keggC:M_C03710 seedM:M_cpd02327	secondary/obsolete/fantasy identifier