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2-coumarate

PropertiesImage
MNX_IDMNXM1364407 Image of MNXM1364407
referencechebi:11594
formulaC9H7O3
global charge-1
mol weight163.152
InChIKeyPMOWTIHVNWZYFI-UHFFFAOYSA-M
InChIInChI=1S/C9H8O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6,10H,(H,11,12)/p-1
SMILESO=C([O-])C=CC1=C(O)C=CC=C1
MNX internals
InChI (mnx)InChI=1/C9H8O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6,10H,(H,11,12)/b6-5? Image of MNXM1364407
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:8]([OH:10])[C:7]([CH:5]=[CH:6][C:9](=[O:11])[OH:12])=[CH:3]1
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
IdentifierDescription

CHEBI:11594
chebi:11594
PMOWTIHVNWZYFI-UHFFFAOYSA-M
2-coumarate
3-(2-hydroxyphenyl)acrylate
3-(2-hydroxyphenyl)prop-2-enoate

sabiork.compound:5793
sabiorkM:5793
PMOWTIHVNWZYFI-UHFFFAOYSA-M
2-Coumarate
2-Coumaric acid
o-Coumaric acid
trans-2-Hydroxycinnamate
trans-2-Hydroxycinnamic acid

sabiork.compound:6698
sabiorkM:6698
PMOWTIHVNWZYFI-UHFFFAOYSA-M
2-Hydroxycinnamate

CHEBI:18176
chebi:18176
PMOWTIHVNWZYFI-UHFFFAOYSA-N
2-coumaric acid
2-Hydroxycinnamate
2-hydroxycinnamic acid
3-(2-hydroxyphenyl)acrylic acid
3-(2-hydroxyphenyl)prop-2-enoic acid
hmdb:HMDB0304296
PMOWTIHVNWZYFI-UHFFFAOYSA-M
coumarinate
2-(2-carboxyeth-1-en-1-yl)benzen-1-olate
2-(2-carboxyeth-1-en-1-yl)benzenolate
2-Coumaric acid
3-(2-Hydroxyphenyl)acrylate
3-(2-Hydroxyphenyl)acrylic acid
Coumarinic acid

chebi:1151
chebi:19517
chebi:19633
secondary/obsolete/fantasy identifier