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5-hydroxypseudobaptigenin

MNXM5016 is deprecated and here replaced by MNXM735109
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM735109 Image of MNXM735109
referencechebi:61339
formulaC16H9O6
global charge-1
mol weight297.242
InChIKeyBNFXYMBRFDJYCH-UHFFFAOYSA-M
InChIInChI=1S/C16H10O6/c17-9-4-11(18)15-14(5-9)20-6-10(16(15)19)8-1-2-12-13(3-8)22-7-21-12/h1-6,17-18H,7H2/p-1
SMILESO=C1C(C2=CC=C3OCOC3=C2)=COC2=C1C(O)=CC([O-])=C2
MNX internals
InChI (mnx)InChI=1/C16H10O6/c17-9-4-11(18)15-14(5-9)20-6-10(16(15)19)8-1-2-12-13(3-8)22-7-21-12/h1-6,17-18H,7H2 Image of MNXM735109
SMILES (mnx)[CH:1]1=[CH:2][C:12]2=[C:13]([CH:3]=[C:8]1[C:10]1=[CH:6][O:20][C:14]3=[CH:5][C:9]([OH:17])=[CH:4][C:11]([OH:18])=[C:15]3[C:16]1=[O:19])[O:22][CH2:7][O:21]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:61339
chebi:61339
BNFXYMBRFDJYCH-UHFFFAOYSA-M 		5-hydroxypseudobaptigenin
3-(1,3-benzodioxol-5-yl)-5-hydroxy-4-oxo-4H-chromen-7-olate
3-(1,3-benzodioxol-5-yl)-5-hydroxy-4H-1-benzopyran-4-on-7-olate
5-hydroxy-3',4'-(methylenedioxy)isoflavone-7-olate
5-hydroxypseudobaptigenin anion
5-hydroxypseudobaptigenin(1-)

lipidmaps:LMPK12050252
lipidmapsM:LMPK12050252
BNFXYMBRFDJYCH-UHFFFAOYSA-N 		5-Hydroxypseudobaptigenin

kegg.compound:C19727
keggC:C19727
BNFXYMBRFDJYCH-UHFFFAOYSA-N 		5-Hydroxypseudobaptigenin
5,7-Dihydroxy-3',4'-methylenedioxyisoflavone

metacyc.compound:CPD-13105
metacycM:CPD-13105
seed.compound:cpd23739
seedM:cpd23739
BNFXYMBRFDJYCH-UHFFFAOYSA-M 		5-hydroxy-pseudobaptigenin

CHEBI:61312
chebi:61312
BNFXYMBRFDJYCH-UHFFFAOYSA-N 		5-hydroxypseudobaptigenin
3-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-4H-1-benzopyran-4-one
3-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-4H-chromen-4-one
3-(benzo[d][1,3]dioxol-5-yl)-5,7-dihydroxy-4H-chromen-4-one
5,7-dihydroxy-3',4'-(methylenedioxy)isoflavone

keggC:M_C19727
seedM:M_cpd23739 		secondary/obsolete/fantasy identifier