Vitas-M small molecule compound

(2Z)-6-{[(2E)-3-phenylprop-2-en-1-yl]oxy}-2-[4-(propan-2-yl)benzylidene]-1-benzofuran-3(2H)-one

Catalog ID
STK627499
SMILES O=C1/C(=C/c2ccc(cc2)C(C)C)/Oc2c1ccc(c2)OC/C=C/c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H24O3 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24O3/c1-19(2)22-12-10-21(11-13-22)17-26-27(28)24-15-14-23(18-25(24)30-26)29-16-6-9-20-7-4-3-5-8-20/h3-15,17-19H,16H2,1-2H3/b9-6+,26-17-
InChIKey
NEPNFPFGQXMEPM-OSJXACKJSA-N
Synonyms
879805-64-8
(2Z)6(((2E)3phenylprop2en1yl)oxy)2(4(propan2yl)benzylidene)1benzofuran3(2H)one
(2Z)6((E)3phenylprop2enoxy)2((4propan2ylphenyl)methylidene)1benzofuran3one
(Z)6(cinnamyloxy)2(4isopropylbenzylidene)benzofuran3(2H)one
6((2E)3PHENYLPROP2ENYLOXY)2((4(METHYLETHYL)PHENYL)METHYLENE)BENZO(B)FURAN3ONE
879805648
CC(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC=CC4=CC=CC=C4
InChI=1SC27H24O3c119(2)22121021(111322)172627(28)24151423(1825(24)3026)291669207435820h3151719H16H212H3b96+2617
MFCD07494730
O=C1C(=Cc2ccc(cc2)C(C)C)Oc2c1ccc(c2)OCC=Cc1ccccc1
ZINC000009532059
ZINC09532059
ZINC9532059

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Available files

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