Vitas-M small molecule compound

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

Catalog ID
STK072545
SMILES COC(=O)C1=C(N)Oc2c(C1c1cccnc1)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 C16H14N2O5 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5/c1-8-6-10-12(16(20)22-8)11(9-4-3-5-18-7-9)13(14(17)23-10)15(19)21-2/h3-7,11H,17H2,1-2H3
InChIKey
MACREFQZRUDUIG-UHFFFAOYSA-N
Synonyms
354553-05-2
354553052
CC1=CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CN=CC=C3)C(=O)O1
COC(=O)C1=C(N)Oc2c(C1c1cccnc1)c(=O)oc(c2)C
InChI=1SC16H14N2O5c1861012(16(20)228)11(94351879)13(14(17)2310)15(19)212h3711H17H212H3
METHYL(4R)2AMINO7METHYL5OXO4(PYRIDIN3YL)4H5HPYRANO(43B)PYRAN3CARBOXYLATE
METHYL2AMINO7METHYL5OXO4(3PYRIDYL)4HPYRANO(32C)PYRAN3CARBOXYLATE
methyl2amino7methyl5oxo4(pyridin3yl)45dihydropyrano(43b)pyran3carboxylate
METHYL2AMINO7METHYL5OXO4(PYRIDIN3YL)4H5HPYRANO(43B)PYRAN3CARBOXYLATE
METHYL2AMINO7METHYL5OXO4PYRIDIN3YL4HPYRANO(32C)PYRAN3CARBOXYLATE
MFCD01606506
STK072545
ZINC000001266780
ZINC000001266781

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.