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

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(E)-cinnamaldehyde

	Properties	Image
MNX_ID	MNXM1364446
reference	chebi:16731
formula	C₉H₈O
global charge	0
mol weight	132.162
InChIKey	KJPRLNWUNMBNBZ-QPJJXVBHSA-N
InChI	InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+
SMILES	O=C/C=C/C1=CC=CC=C1

MNX internals

InChI (mnx)	InChI=1/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+
SMILES (mnx)	[CH:1]1=[CH:2][CH:5]=[C:9](/[CH:7]=[CH:4]/[CH:8]=[O:10])[CH:6]=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	5

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-9737192 reactomeM:R-ALL-9737192 CHEBI:16731 chebi:16731 KJPRLNWUNMBNBZ-QPJJXVBHSA-N	(E)-cinnamaldehyde (3E)-3-phenylprop-2-enal (E)-3-Phenyl-2-propenal (E)-3-Phenyl-propenal (E)-3-Phenylpropenal (E)-Cinnamaldehyde (E)-Cinnamic aldehyde (E)-phenylvinyl aldehyde 3-phenylacrylaldehyde Cinnamaldehyde trans-Cinnamic aldehyde
sabiork.compound:5305 sabiorkM:5305 kegg.compound:C00903 keggC:C00903 KJPRLNWUNMBNBZ-QPJJXVBHSA-N	Cinnamaldehyde
hmdb:HMDB0003441 KJPRLNWUNMBNBZ-QPJJXVBHSA-N	Cinnamaldehyde (2E)-3-Phenyl-2-propenal (2E)-3-Phenylacrylaldehyde (2E)-3-phenylprop-2-enal (E)-3-Phenylacrolein (E)-3-Phenylprop-2-en-1-al (E)-3-Phenylprop-2-enal (E)-3-Phenylprop-2-enone (e)-3-Phenyl-2-propenal (e)-3-Phenyl-propenal (e)-3-Phenylpropenal (e)-Cinnamaldehyde (e)-Cinnamic aldehyde (e)-Phenylvinyl aldehyde 2E)-3-Phenyl-2-propenal 3-Fenylpropenal 3-Phenyl-2-propen-1-al 3-Phenyl-2-propenal 3-Phenyl-2-propenaldehyde 3-Phenyl-2-propene-1-al 3-Phenylacrolein 3-Phenylacrylaldehyde 3-Phenylprop-2-enal 3-Phenylprop-2-enaldehyde 3-Phenylpropenal Benzylideneacetaldehyde Cinnamal Cinnamic aldehyde Cinnamic aldehyde, (e)-isomer Cinnamyl aldehyde Cinnamylaldehyde Cinnemaldehyde E-Cinnamyl aldehyde Supercinnamaldehyde beta-Phenylacrolein beta-Phenylcrolein cinnamal trans-3-Phenyl-2-propenal trans-3-Phenylprop-2-enaldehyde trans-3-Phenylpropenal trans-Benzenepropenal trans-Cinnamaldehyde trans-Cinnamic aldehyde trans-Cinnamylaldehyde
vmhM:cinnmaldh vmhmetabolite:cinnmaldh KJPRLNWUNMBNBZ-QPJJXVBHSA-N	Cinnamaldehyde (2E)-3-phenylprop-2-enal
seed.compound:cpd00670 seedM:cpd00670 KJPRLNWUNMBNBZ-QPJJXVBHSA-N	Cinnamaldehyde (E)-cinnamaldehyde 2-propenal, 3-phenyl- 3-phenylacrylaldehyde Cassia aldehyde Zimtaldehyde cinnamal cinnamaldehyde cinnamic aldehyde phenylacrolein trans-cinnamaldehyde zimtaldehyde
metacyc.compound:CINNAMALDEHYDE metacycM:CINNAMALDEHYDE KJPRLNWUNMBNBZ-QPJJXVBHSA-N	cinnamaldehyde (E)-cinnamaldehyde (incorrect) 2-propenal, 3-phenyl- 3-phenylacrylaldehyde Cassia aldehyde cinnamal cinnamic aldehyde phenylacrolein trans-cinnamaldehyde trans-cinnamaldehyde (incorrect) zimtaldehyde
sabiork.compound:21014 sabiorkM:21014 KJPRLNWUNMBNBZ-QPJJXVBHSA-N	trans-Cinnamaldehyde
hmdb:HMDB03441 chebi:13994 chebi:181858 chebi:23244 chebi:3709 keggC:M_C00903 seedM:M_cpd00670 vmhM:M_cinnmaldh	secondary/obsolete/fantasy identifier