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SIS3 free base

PropertiesImageOccurences in reactions
MNX_IDMNXM161073Image of MNXM161073
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC28H27N3O3
charge0
mass453.20524
referencechebi:87589
InChIKeyIJYPHMXWKKKHGT-VAWYXSNFSA-N
InChIInChI=1S/C28H27N3O3/c1-30-27(19-8-5-4-6-9-19)22(23-10-7-14-29-28(23)30)11-12-26(32)31-15-13-20-16-24(33-2)25(34-3)17-21(20)18-31/h4-12,14,16-17H,13,15,18H2,1-3H3/b12-11+
SMILESCOc1cc2c(cc1OC)CN(C(=O)/C=C/c1c(-c3ccccc3)n(C)c3ncccc13)CC2
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:87589
chebi:87589 		SIS3 free base
(2E)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-(1-methyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)prop-2-en-1-one
CHEBI:87591
chebi:87591 		SIS3 free base(1+)