Vitas-M small molecule compound

(2Z)-7-methyl-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl 2-fluorobenzoate

Catalog ID
STL033460
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C)OC(=O)c2ccccc2F)cc(c1OC)OC

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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 C26H21FO7 MW 464.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FO7/c1-14-19(34-26(29)16-7-5-6-8-18(16)27)10-9-17-23(28)20(33-24(14)17)11-15-12-21(30-2)25(32-4)22(13-15)31-3/h5-13H,1-4H3/b20-11-
InChIKey
FLUKADNYKOIDMR-JAIQZWGSSA-N
Synonyms
859133-91-8
((2Z)7METHYL3OXO2((345TRIMETHOXYPHENYL)METHYLIDENE)1BENZOFURAN6YL)2FLUOROBENZOATE
(2Z)7methyl3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6yl2fluorobenzoate
(Z)7methyl3oxo2(345trimethoxybenzylidene)23dihydrobenzofuran6yl2fluorobenzoate
7METHYL3OXO2((345TRIMETHOXYPHENYL)METHYLENE)BENZO(34B)FURAN6YL2FLUOROBENZOATE
859133918
CC1=C(C=CC2=C1OC(=CC3=CC(=C(C(=C3)OC)OC)OC)C2=O)OC(=O)C4=CC=CC=C4F
COc1cc(C=C2Oc3c(C2=O)ccc(c3C)OC(=O)c2ccccc2F)cc(c1OC)OC
InChI=1SC26H21FO7c11419(3426(29)16756818(16)27)1091723(28)20(3324(14)17)11151221(302)25(324)22(1315)313h513H14H3b2011
MFCD06493141
ZINC000011866186
ZINC11866186

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Available files

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