Vitas-M small molecule compound
propan-2-yl ({(2E)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate
Catalog ID
STK623890
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OCC(=O)OC(C)C)cn2CC
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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 C25H25NO6 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO6/c1-5-26-13-16(20-11-17(29-4)7-9-21(20)26)10-23-25(28)19-8-6-18(12-22(19)32-23)30-14-24(27)31-15(2)3/h6-13,15H,5,14H2,1-4H3/b23-10+InChIKey
XBBIHEASZAOLOL-AUEPDCJTSA-NSynonyms
929510-91-8(E)isopropyl2((2((1ethyl5methoxy1Hindol3yl)methylene)3oxo23dihydrobenzofuran6yl)oxy)acetate
929510918
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OCC(=O)OC(C)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3)OCC(=O)OC(C)C)cn2CC
InChI=1SC25H25NO6c15261316(201117(294)7921(20)26)102325(28)198618(1222(19)3223)301424(27)3115(2)3h61315H514H214H3b2310+
MFCD09796027
propan2yl(((2E)2((1ethyl5methoxy1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
propan2yl2(((2E)2((1ethyl5methoxyindol3yl)methylidene)3oxo1benzofuran6yl)oxy)acetate
ZINC000009423950
ZINC09423950
ZINC9423950
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