Vitas-M small molecule compound

(2Z)-6-(benzyloxy)-2-(3,4,5-trimethoxybenzylidene)-1-benzofuran-3(2H)-one

Catalog ID
STK923908
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2ccccc2)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 C25H22O6 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22O6/c1-27-22-12-17(13-23(28-2)25(22)29-3)11-21-24(26)19-10-9-18(14-20(19)31-21)30-15-16-7-5-4-6-8-16/h4-14H,15H2,1-3H3/b21-11-
InChIKey
JTRIWTAMUBNYNR-NHDPSOOVSA-N
Synonyms
859139-58-5
(2Z)6(benzyloxy)2(345trimethoxybenzylidene)1benzofuran3(2H)one
(2Z)6PHENYLMETHOXY2((345TRIMETHOXYPHENYL)METHYLIDENE)1BENZOFURAN3ONE
(Z)6(benzyloxy)2(345trimethoxybenzylidene)benzofuran3(2H)one
6(PHENYLMETHOXY)2((345TRIMETHOXYPHENYL)METHYLENE)BENZO(B)FURAN3ONE
859139585
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=CC=C4
COc1cc(C=C2Oc3c(C2=O)ccc(c3)OCc2ccccc2)cc(c1OC)OC
InChI=1SC25H22O6c127221217(1323(282)25(22)293)112124(26)1910918(1420(19)3121)3015167546816h414H15H213H3b2111
MFCD04147096
ZINC000012863056
ZINC12863056

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.