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

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cathine

	Properties	Image
MNX_ID	MNXM5856
reference	chebi:4109
formula	C₉H₁₃NO
global charge	0
mol weight	151.209
InChIKey	DLNKOYKMWOXYQA-IONNQARKSA-N
InChI	InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9+/m0/s1
SMILES	C[C@H](N)[C@@H](O)C1=CC=CC=C1

MNX internals

InChI (mnx)	InChI=1/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9+/m0/s1
SMILES (mnx)	[CH3:1][C@@H:7]([C@H:9]([C:8]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)[OH:11])[NH2:10]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:4109 chebi:4109 DLNKOYKMWOXYQA-IONNQARKSA-N	cathine (+)-cathine (+)-norpseudoephedrine (+)-pseudonorephedrine (1S,2S)-(+)-norpseudoephedrine (1S,2S)-2-amino-1-phenyl-1-propanol (1S,2S)-2-amino-1-phenylpropan-1-ol (1S,2S)-norpseudoephedrine D-(+)-norpseudoephedrine D-cathine D-norpseudoephedrine d-norpseudoephedrine katine
metacyc.compound:CPD-9953 metacycM:CPD-9953 DLNKOYKMWOXYQA-IONNQARKSA-O	(1S,2S)-norpseudoephedrine (+)-norpseudoephedrine (1S,2S)-(+)-norpseudoephedrine (1S,2S)-2-amino-1-phenylpropan-1-ol D-cathine
vmhM:cthn vmhmetabolite:cthn DLNKOYKMWOXYQA-IONNQARKSA-N	Cathine
kegg.drug:D07627 keggD:D07627 DLNKOYKMWOXYQA-IONNQARKSA-N	Cathine (INN) (+)-Norpseudoephedrine
seed.compound:cpd05215 seedM:cpd05215 DLNKOYKMWOXYQA-IONNQARKSA-O	Cathine (+)-Norpseudoephedrine (+)-norpseudoephedrine (1S,2S)-(+)-norpseudoephedrine (1S,2S)-2-amino-1-phenylpropan-1-ol D-Cathine D-cathine norpseudoephedrine
kegg.compound:C08300 keggC:C08300 DLNKOYKMWOXYQA-IONNQARKSA-N	D-Cathine (+)-Norpseudoephedrine Cathine
keggC:M_C08300 keggD:M_D07627 seedM:M_cpd05215 vmhM:M_cthn	secondary/obsolete/fantasy identifier