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(E)-sinapaldehyde

PropertiesImage
MNX_IDMNXM2283 Image of MNXM2283
referencechebi:27949
formulaC11H12O4
global charge0
mol weight208.213
InChIKeyCDICDSOGTRCHMG-ONEGZZNKSA-N
InChIInChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+
SMILESCOC1=CC(/C=C/C=O)=CC(OC)=C1O
MNX internals
InChI (mnx)InChI=1/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+ Image of MNXM2283
SMILES (mnx)[CH3:1][O:14][C:9]1=[C:11]([OH:13])[C:10]([O:15][CH3:2])=[CH:7][C:8](/[CH:4]=[CH:3]/[CH:5]=[O:12])=[CH:6]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)11
in models (compartimentalized) 8
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27949
chebi:27949
CDICDSOGTRCHMG-ONEGZZNKSA-N 		(E)-sinapaldehyde
(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylaldehyde
(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enal
(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenal
(E)-sinapoyl aldehyde
Sinapaldehyde
Sinapoyl aldehyde
sinapyl aldehyde

vmhM:sinapaldh
vmhmetabolite:sinapaldh
CDICDSOGTRCHMG-ONEGZZNKSA-N 		Sinapaldehyde

seed.compound:cpd03333
seedM:cpd03333
CDICDSOGTRCHMG-ONEGZZNKSA-N 		Sinapaldehyde
Sinapoyl aldehyde
sinapaldehyde
sinapinaldehyde

kegg.compound:C05610
keggC:C05610
CDICDSOGTRCHMG-ONEGZZNKSA-N 		Sinapoyl aldehyde
Sinapaldehyde

sabiork.compound:8009
sabiorkM:8009
CDICDSOGTRCHMG-ONEGZZNKSA-N 		Sinapoyl aldehyde
Sinapaldehyde
Sinapyl aldehyde

metacyc.compound:SINAPALDEHYDE
metacycM:SINAPALDEHYDE
CDICDSOGTRCHMG-ONEGZZNKSA-N 		sinapaldehyde

chebi:26684
chebi:9153
keggC:M_C05610
seedM:M_cpd03333
vmhM:M_sinapaldh 		secondary/obsolete/fantasy identifier