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pulcherriminic acid

PropertiesImage
MNX_IDMNXM108321 Image of MNXM108321
referencechebi:77663
formulaC12H18N2O4
global charge-2
mol weight254.286
InChIKeyWXWWNANFOZVVLD-UHFFFAOYSA-L
InChIInChI=1S/C12H20N2O4/c1-7(2)5-9-11(15)14(18)10(6-8(3)4)12(16)13(9)17/h7-8,15-16H,5-6H2,1-4H3/p-2
SMILESCC(C)CC1=C([O-])[N+]([O-])=C(CC(C)C)C([O-])=[N+]1[O-]
MNX internals
InChI (mnx)InChI=1/C12H20N2O4/c1-7(2)5-9-11(15)14(18)10(6-8(3)4)12(16)13(9)17/h7-8,15-16H,5-6H2,1-4H3 Image of MNXM108321
SMILES (mnx)[CH3:1][CH:7]([CH3:2])[CH2:5][C:9]1=[C:11]([OH:15])[N+:14](=[O:18])[C:10]([CH2:6][CH:8]([CH3:3])[CH3:4])=[C:12]([OH:16])[N:13]1[O-:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77663
chebi:77663
WXWWNANFOZVVLD-UHFFFAOYSA-L 		pulcherriminic acid
3,6-diisobutylpyrazine-2,5-diolate 1,4-dioxide
pulcherriminate(2-)
pulcherriminic acid(2-)

kegg.compound:C20515
keggC:C20515
WXWWNANFOZVVLD-UHFFFAOYSA-N 		Pulcherriminic acid
2,5-Dihydroxy-3,6-bis(2-methylpropyl)pyrazine bis-N-oxide

seed.compound:cpd31158
seedM:cpd31158
WXWWNANFOZVVLD-UHFFFAOYSA-L 		Pulcherriminic acid
2,5-Dihydroxy-3,6-bis(2-methylpropyl)pyrazine bis-N-oxide
pulcherriminate
pulcherriminic acid

CHEBI:71599
chebi:71599
WXWWNANFOZVVLD-UHFFFAOYSA-N 		pulcherriminic acid
2,5-Diisobutyl-3,6-dihydroxy-pyrazine-1,4-dioxide
3,6-diisobutylpyrazine-2,5-diol 1,4-dioxide

metacyc.compound:CPD-15211
metacycM:CPD-15211
WXWWNANFOZVVLD-UHFFFAOYSA-L 		pulcherriminic acid
pulcherriminate

keggC:M_C20515
seedM:M_cpd31158 		secondary/obsolete/fantasy identifier