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dehydrogriseofulvin

PropertiesImage
MNX_IDMNXM48928 Image of MNXM48928
referencechebi:81999
formulaC17H15ClO6
global charge0
mol weight350.754
InChIKeyISLYVROQSJYFAZ-KRWDZBQOSA-N
InChIInChI=1S/C17H15ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h5-7H,1-4H3/t17-/m0/s1
SMILESCOC1=CC(OC)=C2C(=O)[C@]3(OC2=C1Cl)C(C)=CC(=O)C=C3OC
MNX internals
InChI (mnx)InChI=1/C17H15ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h5-7H,1-4H3/t17-/m0/s1 Image of MNXM48928
SMILES (mnx)[CH3:1][C:8]1=[CH:5][C:9](=[O:19])[CH:6]=[C:12]([O:23][CH3:4])[C@:17]12[C:16](=[O:20])[C:13]1=[C:15]([C:14]([Cl:18])=[C:11]([O:22][CH3:3])[CH:7]=[C:10]1[O:21][CH3:2])[O:24]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:81999
chebi:81999
ISLYVROQSJYFAZ-KRWDZBQOSA-N
dehydrogriseofulvin
Dehydrogriseofulvin

kegg.compound:C18838
keggC:C18838
ISLYVROQSJYFAZ-KRWDZBQOSA-N
Dehydrogriseofulvin

seed.compound:cpd20099
seedM:cpd20099
ISLYVROQSJYFAZ-KRWDZBQOSA-N
Dehydrogriseofulvin
dehydrogriseofulvin

metacyc.compound:CPD-17793
metacycM:CPD-17793
ISLYVROQSJYFAZ-KRWDZBQOSA-N
dehydrogriseofulvin

keggC:M_C18838
seedM:M_cpd20099
secondary/obsolete/fantasy identifier