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1,6-Dimethoxypyrene

PropertiesImage
MNX_IDMNXM13856 Image of MNXM13856
referencechebi:81611
formulaC18H14O2
global charge0
mol weight262.308
InChIKeyWFKVWBRLOQDNIT-UHFFFAOYSA-N
InChIInChI=1S/C18H14O2/c1-19-15-9-5-11-4-8-14-16(20-2)10-6-12-3-7-13(15)17(11)18(12)14/h3-10H,1-2H3
SMILESCOC1=CC=C2C=CC3=C(OC)C=CC4=C3C2=C1C=C4
MNX internals
InChI (mnx)InChI=1/C18H14O2/c1-19-15-9-5-11-4-8-14-16(20-2)10-6-12-3-7-13(15)17(11)18(12)14/h3-10H,1-2H3 Image of MNXM13856
SMILES (mnx)[CH3:1][O:19][C:15]1=[C:13]2[CH:7]=[CH:3][C:12]3=[CH:6][CH:10]=[C:16]([O:20][CH3:2])[C:14]4=[C:18]3[C:17]2=[C:11]([CH:4]=[CH:8]4)[CH:5]=[CH:9]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

envipath:...ea69245f68c2
envipathM:...ea69245f68c2
seed.compound:cpd19526
seedM:cpd19526
CHEBI:81611
chebi:81611
kegg.compound:C18260
keggC:C18260
WFKVWBRLOQDNIT-UHFFFAOYSA-N
1,6-Dimethoxypyrene
hmdb:HMDB0060337
WFKVWBRLOQDNIT-UHFFFAOYSA-N
1,6-Dimethoxypyrene
1,6-dimethoxypyrene

hmdb:HMDB60337
keggC:M_C18260
seedM:M_cpd19526
secondary/obsolete/fantasy identifier