Vitas-M small molecule compound

4-(2-amino-3-cyano-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-4-yl)phenyl furan-2-carboxylate

Catalog ID
STK765475
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC(=O)c1ccco1)c(=O)oc(c2)C

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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 C21H14N2O6 MW 390.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O6/c1-11-9-16-18(21(25)27-11)17(14(10-22)19(23)29-16)12-4-6-13(7-5-12)28-20(24)15-3-2-8-26-15/h2-9,17H,23H2,1H3
InChIKey
RMXUALAAIXTJIT-UHFFFAOYSA-N
Synonyms

(4(2AMINO3CYANO7METHYL5OXO4HPYRANO(32C)PYRAN4YL)PHENYL)FURAN2CARBOXYLATE
4((4S)2AMINO3CYANO7METHYL5OXO4H5HPYRANO(43B)PYRAN4YL)PHENYLFURAN2CARBOXYLATE
4(2amino3cyano7methyl5oxo4H5Hpyrano(43b)pyran4yl)phenylfuran2carboxylate
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)OC(=O)C4=CC=CO4)C(=O)O1
InChI=1SC21H14N2O6c11191618(21(25)2711)17(14(1022)19(23)2916)124613(7512)2820(24)153282615h2917H23H21H3
MFCD03035622
ZINC000001068171
ZINC000001068175

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Available files

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