Vitas-M small molecule compound

(2Z)-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4,5-trimethoxybenzoate

Catalog ID
STK923659
SMILES COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C)/C2=O

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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 C26H22O7 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22O7/c1-15-5-7-16(8-6-15)11-21-24(27)19-10-9-18(14-20(19)33-21)32-26(28)17-12-22(29-2)25(31-4)23(13-17)30-3/h5-14H,1-4H3/b21-11-
InChIKey
PKCCYHZCTBCVKA-NHDPSOOVSA-N
Synonyms
859138-30-0
((2Z)2((4METHYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)345TRIMETHOXYBENZOATE
(2Z)2(4methylbenzylidene)3oxo23dihydro1benzofuran6yl345trimethoxybenzoate
(Z)2(4methylbenzylidene)3oxo23dihydrobenzofuran6yl345trimethoxybenzoate
2((4METHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL345TRIMETHOXYBENZOATE
859138300
CC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC
COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)C)C2=O
InChI=1SC26H22O7c1155716(8615)112124(27)1910918(1420(19)3321)3226(28)171222(292)25(314)23(1317)303h514H14H3b2111
MFCD04146659
ZINC000002107382
ZINC02107382
ZINC2107382

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Available files

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