Vitas-M small molecule compound
(2E)-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl cyclohexanecarboxylate
Catalog ID
STK992994
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)C1CCCCC1)cn2C
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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 C26H25NO5 MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO5/c1-27-15-17(21-13-18(30-2)9-11-22(21)27)12-24-25(28)20-10-8-19(14-23(20)32-24)31-26(29)16-6-4-3-5-7-16/h8-16H,3-7H2,1-2H3/b24-12+InChIKey
CTPUORKZJJHVLL-WYMPLXKRSA-NSynonyms
929511-51-3((2E)2((5methoxy1methylindol3yl)methylidene)3oxo1benzofuran6yl)cyclohexanecarboxylate
(2E)2((5methoxy1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6ylcyclohexanecarboxylate
(E)2((5methoxy1methyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6ylcyclohexanecarboxylate
2((5METHOXY1METHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YLCYCLOHEXANECARBOXYLATE
929511513
CN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5CCCCC5
InChI=1SC26H25NO5c1271517(211318(302)91122(21)27)122425(28)2010819(1423(20)3224)3126(29)166435716h816H37H212H3b2412+
MFCD09844280
ZINC000009421052
ZINC09421052
ZINC9421052
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