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4-(3-pyridyl)-3-butenoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM10156

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

formula

C₉H₈NO₂

charge

-1

mass

162.05605

reference

InChIKey

MHVJWSPYMHAALE-HNQUOIGGSA-M

InChI

InChI=1S/C9H9NO2/c11-9(12)5-1-3-8-4-2-6-10-7-8/h1-4,6-7H,5H2,(H,11,12)/p-1/b3-1+

SMILES

O=C([O-])C/C=C/c1cccnc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-3194 metacycM:CPD-3194 seed.compound:cpd24403 seedM:cpd24403	4-(3-pyridyl)-3-butenoate 4-(3-pyridyl)-3-butenoic acid
hmdb:HMDB0001424	4-(3-Pyridyl)-3-butenoic acid (3E)-4-(Pyridin-3-yl)but-3-enoate (3E)-4-(pyridin-3-yl)but-3-enoic acid 4-(3-Pyridyl)-3-butenoate 4-(3-pyridyl)-3-butenoic acid
hmdb:HMDB01424 seedM:M_cpd24403	secondary/obsolete/fantasy identifier