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2-O,3-dimethylflaviolin

PropertiesImage
MNX_IDMNXM145837 Image of MNXM145837
referencechebi:78589
formulaC12H9O5
global charge-1
mol weight233.199
InChIKeyMMVQTVRCJUHCSV-UHFFFAOYSA-M
InChIInChI=1S/C12H10O5/c1-5-10(15)9-7(11(16)12(5)17-2)3-6(13)4-8(9)14/h3-4,13-14H,1-2H3/p-1
SMILESCOC1=C(C)C(=O)C2=C(C=C([O-])C=C2O)C1=O
MNX internals
InChI (mnx)InChI=1/C12H10O5/c1-5-10(15)9-7(11(16)12(5)17-2)3-6(13)4-8(9)14/h3-4,13-14H,1-2H3 Image of MNXM145837
SMILES (mnx)[CH3:1][C:5]1=[C:12]([O:17][CH3:2])[C:11](=[O:16])[C:7]2=[C:9]([C:8]([OH:14])=[CH:4][C:6]([OH:13])=[CH:3]2)[C:10]1=[O:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:78589
chebi:78589
MMVQTVRCJUHCSV-UHFFFAOYSA-M 		2-O,3-dimethylflaviolin
2-O,3-dimethylflaviolin-7-olate
2-methoxy-3-methylflaviolin-7-olate
4-hydroxy-7-methoxy-6-methyl-5,8-dioxo-5,8-dihydronaphthalen-2-olate

kegg.compound:C21001
keggC:C21001
MMVQTVRCJUHCSV-UHFFFAOYSA-N 		2-O,3-Dimethylflaviolin

metacyc.compound:CPD-16658
metacycM:CPD-16658
seed.compound:cpd32017
seedM:cpd32017
MMVQTVRCJUHCSV-UHFFFAOYSA-N 		2-O,3-dimethylflaviolin
2-O-methyl-3-methylflaviolin
5,7-dihydroxy-2-methoxy-3-methylnaphthalene-1,4-dione

CHEBI:82611
chebi:82611
MMVQTVRCJUHCSV-UHFFFAOYSA-N 		2-O,3-dimethylflaviolin
2-methoxy-3-methylflaviolin
5,7-dihydroxy-2-methoxy-3-methyl-1,4-naphthoquinone

keggC:M_C21001
seedM:M_cpd32017 		secondary/obsolete/fantasy identifier