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

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dopamine

	Properties	Image
MNX_ID	MNXM205
reference	chebi:59905
formula	C₈H₁₂NO₂
global charge	1
mol weight	154.189
InChIKey	VYFYYTLLBUKUHU-UHFFFAOYSA-O
InChI	InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2/p+1
SMILES	[NH3+]CCC1=CC=C(O)C(O)=C1

MNX internals

InChI (mnx)	InChI=1/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
SMILES (mnx)	[CH:1]1=[CH:2][C:7]([OH:10])=[C:8]([OH:11])[CH:5]=[C:6]1[CH2:3][CH2:4][NH2:9]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	73
in models (compartimentalized)	49

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-159362 reactomeM:R-ALL-159362 reactome:R-ALL-351601 reactomeM:R-ALL-351601 reactome:R-ALL-380873 reactomeM:R-ALL-380873 CHEBI:59905 chebi:59905 VYFYYTLLBUKUHU-UHFFFAOYSA-O	dopamine 2-(3,4-dihydroxyphenyl)ethan-1-aminium 2-(3,4-dihydroxyphenyl)ethanaminium dopaminium cation dopaminium(1+)
sabiork.compound:20037 sabiorkM:20037 VYFYYTLLBUKUHU-UHFFFAOYSA-N	3,4-Dihydroxyphenethylamine
bigg.metabolite:dopa biggM:dopa VYFYYTLLBUKUHU-UHFFFAOYSA-O	Dopamine
kegg.drug:D07870 keggD:D07870 VYFYYTLLBUKUHU-UHFFFAOYSA-N	Dopamine (INN) Medopa (TN)
seed.compound:cpd02357 seedM:cpd02357 VYFYYTLLBUKUHU-UHFFFAOYSA-O	Dopamine 2-(3,4-Dihydroxyphenyl)ethylamine 2-(3,4-dihydroxyphenyl)ethylamine 3,4-Dihydroxyphenethylamine 3,4-dihydroxyphenethylamine 3-hydroxytyramine 4-(2-Aminoethyl)-1,2-benzenediol 4-(2-Aminoethyl)benzene-1,2-diol 4-(2-aminoethyl)benzene-1,2-diol deoxyepinephrine dopa dopamine hydroxytyramine intropin
hmdb:HMDB0000073 VYFYYTLLBUKUHU-UHFFFAOYSA-N	Dopamine 2-(3,4-Dihydroxyphenyl)ethylamine 3,4 Dihydroxyphenethylamine 3,4-Dihydroxyphenethylamine 3,4-Dihydroxyphenylethylamine 3-Hydroxytyramine 4-(2-Aminoethyl)-1,2-benzenediol 4-(2-Aminoethyl)-pyrocatechol 4-(2-Aminoethyl)benzene-1,2-diol 4-(2-Aminoethyl)catechol 4-(2-Aminoethyl)pyrocatechol 4-(2-aminoethyl)benzene-1,2-diol Deoxyepinephrine Dopamin Dopamina Dopamine hydrochloride Dopaminum Dopastat Dophamine Dynatra Hydrochloride, dopamine Hydroxytyramin Hydroxytyramine Intropin Medopa Oxytyramine Revivan a-(3,4-Dihydroxyphenyl)-b-aminoethane alpha-(3,4-Dihydroxyphenyl)-beta-aminoethane dopamine
kegg.compound:C03758 keggC:C03758 VYFYYTLLBUKUHU-UHFFFAOYSA-N	Dopamine 2-(3,4-Dihydroxyphenyl)ethylamine 3,4-Dihydroxyphenethylamine 4-(2-Aminoethyl)-1,2-benzenediol 4-(2-Aminoethyl)benzene-1,2-diol
sabiork.compound:6836 sabiorkM:6836 VYFYYTLLBUKUHU-UHFFFAOYSA-N	Dopamine 2-(3,4-Dihydroxyphenyl)ethylamine 4-(2-Aminoethyl)-1,2-benzenediol 4-(2-Aminoethyl)benzene-1,2-diol L-Dopamine
vmhM:dopa vmhmetabolite:dopa VYFYYTLLBUKUHU-UHFFFAOYSA-O	Dopamine 4-(2-aminoethyl)benzene-1,2-diol
envipath:...b97abf5dc03c envipathM:...b97abf5dc03c VYFYYTLLBUKUHU-UHFFFAOYSA-N	compound 0044331
CHEBI:18243 chebi:18243 VYFYYTLLBUKUHU-UHFFFAOYSA-N	dopamine 2-(3,4-Dihydroxyphenyl)ethylamine 2-(3,4-dihydroxyphenyl)ethylamine 3,4-Dihydroxyphenethylamine 3-Hydroxytyramine 4-(2-Aminoethyl)-1,2-benzenediol 4-(2-Aminoethyl)benzene-1,2-diol 4-(2-aminoethyl)-1,2-benzenediol 4-(2-aminoethyl)benzene-1,2-diol 4-(2-aminoethyl)catechol 4-(2-aminoethyl)pyrocatechol Deoxyepinephrine Dopamine Hydroxytyramin dopamina dopaminum
metacyc.compound:DOPAMINE metacycM:DOPAMINE VYFYYTLLBUKUHU-UHFFFAOYSA-O	dopamine 2-(3,4-dihydroxyphenyl)ethylamine 3,4-dihydroxyphenethylamine 3-hydroxytyramine 4-(2-aminoethyl)benzene-1,2-diol deoxyepinephrine hydroxytyramine intropin
hmdb:HMDB00073 hmdb:HMDB0060277 hmdb:HMDB60277 chebi:11695 chebi:11930 chebi:14203 chebi:1764 chebi:23886 chebi:43686 biggM:M_dopa keggC:M_C03758 keggD:M_D07870 seedM:M_cpd02357 vmhM:M_dopa	secondary/obsolete/fantasy identifier