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Combretastatin A4

PropertiesImage
MNX_IDMNXM103997 Image of MNXM103997
referencechebi:181391
formulaC18H20O5
global charge0
mol weight316.353
InChIKeyHVXBOLULGPECHP-WAYWQWQTSA-N
InChIInChI=1S/C18H20O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h5-11,19H,1-4H3/b6-5-
SMILESCOC1=CC(/C=C\C2=CC(O)=C(OC)C=C2)=CC(OC)=C1OC
MNX internals
InChI (mnx)InChI=1/C18H20O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h5-11,19H,1-4H3/b6-5- Image of MNXM103997
SMILES (mnx)[CH3:1][O:20][C:15]1=[C:14]([OH:19])[CH:9]=[C:12](/[CH:5]=[CH:6]\[C:13]2=[CH:10][C:16]([O:21][CH3:2])=[C:18]([O:23][CH3:4])[C:17]([O:22][CH3:3])=[CH:11]2)[CH:7]=[CH:8]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:181391
chebi:181391
HVXBOLULGPECHP-WAYWQWQTSA-N
Combretastatin A4
2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol

seed.compound:cpd21498
seedM:cpd21498
kegg.compound:C20268
keggC:C20268
HVXBOLULGPECHP-WAYWQWQTSA-N
Combretastatin A-4
Combretastatin A4

keggC:M_C20268
seedM:M_cpd21498
secondary/obsolete/fantasy identifier