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

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D-lysopine

	Properties	Image
MNX_ID	MNXM3966
reference	chebi:58058
formula	C₉H₁₈N₂O₄
global charge	0
mol weight	218.253
InChIKey	ZZYYVZYAZCMNPG-RQJHMYQMSA-N
InChI	InChI=1S/C9H18N2O4/c1-6(8(12)13)11-7(9(14)15)4-2-3-5-10/h6-7,11H,2-5,10H2,1H3,(H,12,13)(H,14,15)/t6-,7+/m1/s1
SMILES	C[C@@H]([NH2+][C@@H](CCCC[NH3+])C(=O)[O-])C(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C9H18N2O4/c1-6(8(12)13)11-7(9(14)15)4-2-3-5-10/h6-7,11H,2-5,10H2,1H3,(H,12,13)(H,14,15)/t6-,7+/m1/s1
SMILES (mnx)	[CH3:1][C@H:6]([C:8](=[O:12])[OH:13])[NH:11][C@@H:7]([CH2:4][CH2:2][CH2:3][CH2:5][NH2:10])[C:9](=[O:14])[OH:15]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58058 chebi:58058 ZZYYVZYAZCMNPG-RQJHMYQMSA-N	D-lysopine (2S)-6-azaniumyl-2-{[(1R)-1-carboxylatoethyl]azaniumyl}hexanoate D-lysopine dizwitterion D-lysopine zwitterion
kegg.compound:C04020 keggC:C04020 ZZYYVZYAZCMNPG-RQJHMYQMSA-N	D-Lysopine Lysopine N2-(D-1-Carboxyethyl)-L-lysine
CHEBI:17213 chebi:17213 ZZYYVZYAZCMNPG-RQJHMYQMSA-N	D-lysopine (R)-N(2)-(1-Carboxyethyl)-L-lysine D-Lysopine Lysopine N(2)-(D-1-carboxyethyl)-L-lysine N(2)-[(1R)-1-carboxyethyl]-L-lysine N2-(D-1-Carboxyethyl)-L-lysine
metacyc.compound:CPD-306 metacycM:CPD-306 ZZYYVZYAZCMNPG-RQJHMYQMSA-N	D-lysopine (R)-N(2)-(1-carboxyethyl)-L-lysine N2-(D-1-carboxyethyl)-L-lysine
vmhM:lypn vmhmetabolite:lypn ZZYYVZYAZCMNPG-RQJHMYQMSA-N	Lysopine
seed.compound:cpd02490 seedM:cpd02490 ZZYYVZYAZCMNPG-RQJHMYQMSA-N	Lysopine (R)-N(2)-(1-carboxyethyl)-L-lysine D-Lysopine D-lysopine N2-(D-1-Carboxyethyl)-L-lysine N2-(D-1-carboxyethyl)-L-lysine
chebi:12632 chebi:21811 chebi:7367 keggC:M_C04020 seedM:M_cpd02490 vmhM:M_lypn	secondary/obsolete/fantasy identifier