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3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

PropertiesImage
MNX_IDMNXM162628 Image of MNXM162628
referencechebi:84355
formulaC9H9O4
global charge-1
mol weight181.167
InChIKeyMPMDLNLJFJLITQ-RBSILHGTSA-M
InChIInChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1,3,5,7,10H,2,4H2,(H,12,13)/p-1/b6-5-/t7-/m0/s1
SMILESO=C([O-])C(=O)/C=C1/C=C[C@H](O)CC1
MNX internals
InChI (mnx)InChI=1/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1,3,5,7,10H,2,4H2,(H,12,13)/b6-5-/t7-/m0/s1 Image of MNXM162628
SMILES (mnx)[CH:1]1=[CH:3][C@H:7]([OH:10])[CH2:4][CH2:2]/[C:6]1=[CH:5]\[C:8]([C:9]([OH:12])=[O:13])=[O:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:84355
chebi:84355
MPMDLNLJFJLITQ-RBSILHGTSA-M 		3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate
(3E)-3-[(4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoate

kegg.compound:C21085
keggC:C21085
MPMDLNLJFJLITQ-RBSILHGTSA-N 		3-[(1E,4R)-4-Hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoate

metacyc.compound:CPD-17511
metacycM:CPD-17511
seed.compound:cpd33126
seedM:cpd33126
MPMDLNLJFJLITQ-RBSILHGTSA-M 		3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoate

CHEBI:85357
chebi:85357
MPMDLNLJFJLITQ-RBSILHGTSA-N 		3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid
(3E)-3-[(4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoic acid
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoic acid

keggC:M_C21085
seedM:M_cpd33126 		secondary/obsolete/fantasy identifier