Vitas-M small molecule compound
(2Z)-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-1-benzofuran-6-yl 2,6-dimethoxybenzoate
Catalog ID
STK924435
SMILES COc1cccc(c1C(=O)Oc1ccc2c(c1)O/C(=C\C=C\c1ccccc1)/C2=O)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 C26H20O6 MW 428.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20O6/c1-29-20-11-7-12-21(30-2)24(20)26(28)31-18-14-15-19-23(16-18)32-22(25(19)27)13-6-10-17-8-4-3-5-9-17/h3-16H,1-2H3/b10-6+,22-13-InChIKey
DQKAQYMMVPTNJI-ZLBXDVNXSA-NSynonyms
622796-17-2((2Z)3OXO2((E)3PHENYLPROP2ENYLIDENE)1BENZOFURAN6YL)26DIMETHOXYBENZOATE
(2Z)3oxo2((2E)3phenylprop2en1ylidene)23dihydro1benzofuran6yl26dimethoxybenzoate
(Z)3oxo2((E)3phenylallylidene)23dihydrobenzofuran6yl26dimethoxybenzoate
2((2E)3PHENYLPROP2ENYLIDENE)3OXOBENZO(34B)FURAN6YL26DIMETHOXYBENZOATE
622796172
COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC=CC4=CC=CC=C4)O3
COc1cccc(c1C(=O)Oc1ccc2c(c1)OC(=CC=Cc1ccccc1)C2=O)OC
InChI=1SC26H20O6c129201171221(302)24(20)26(28)311814151923(1618)3222(25(19)27)13610178435917h316H12H3b106+2213
MFCD04143522
ZINC000011869604
ZINC11869604
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