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2-hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate

MNXM35122 is deprecated and here replaced by MNXM1371585
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371585 Image of MNXM1371585
referencemetacycM:CPD-1007
formulaC10H10O6
global charge-2
mol weight226.184
InChIKeyQIADQBIXDULDTJ-PBOULFJWSA-L
InChIInChI=1S/C10H12O6/c1-5(2)7(11)4-3-6(9(13)14)8(12)10(15)16/h3-5,12H,1-2H3,(H,13,14)(H,15,16)/p-2/b4-3+,8-6+
SMILESCC(C)C(=O)/C=C/C(C(=O)[O-])=C(\O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H12O6/c1-5(2)7(11)4-3-6(9(13)14)8(12)10(15)16/h3-5,12H,1-2H3,(H,13,14)(H,15,16)/b4-3+,8-6+ Image of MNXM1371585
SMILES (mnx)[CH3:1][CH:5]([CH3:2])[C:7](/[CH:4]=[CH:3]/[C:6](=[C:8](/[C:10](=[O:15])[OH:16])[OH:12])[C:9](=[O:13])[OH:14])=[O:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-1007
metacycM:CPD-1007
QIADQBIXDULDTJ-PBOULFJWSA-L 		2-hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate