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HPK

PropertiesImage
MNX_IDMNXM1371071 Image of MNXM1371071
referencechebi:228828
formulaC12H10O4
global charge0
mol weight218.208
InChIKeyQPGAZPBFRAAJBD-XBXARRHUSA-N
InChIInChI=1S/C12H10O4/c13-10(9-5-2-1-3-6-9)7-4-8-11(14)12(15)16/h1-6,8H,7H2,(H,15,16)/b8-4+
SMILESO=C(O)C(=O)/C=C/CC(=O)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C12H10O4/c13-10(9-5-2-1-3-6-9)7-4-8-11(14)12(15)16/h1-6,8H,7H2,(H,15,16)/b8-4+ Image of MNXM1371071
SMILES (mnx)[CH:1]1=[CH:2][CH:5]=[C:9]([C:10]([CH2:7]/[CH:4]=[CH:8]/[C:11]([C:12]([OH:15])=[O:16])=[O:14])=[O:13])[CH:6]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:228828
chebi:228828
QPGAZPBFRAAJBD-XBXARRHUSA-N 		HPK
(E)-2,6-dioxo-6-phenylhex-3-enoic acid

seed.compound:cpd00935
seedM:cpd00935
QPGAZPBFRAAJBD-XBXARRHUSA-M 		2,6-Dioxo-6-phenylhexa-3-enoate
2,6-dioxo-6-phenylhexa-3-enoate
2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate

metacyc.compound:CPD-14298
metacycM:CPD-14298
QPGAZPBFRAAJBD-XBXARRHUSA-M 		2,6-dioxo-6-phenylhexa-3-enoate

seedM:M_cpd00935 		secondary/obsolete/fantasy identifier