Vitas-M small molecule compound
methyl 4-[5-(5-hydroxy-7-methyl-2-oxo-3,4-dihydro-2H-pyrano[3,2-c]pyridin-4-yl)furan-2-yl]benzoate
Catalog ID
STL311313
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)C1CC(=O)Oc2c1c(O)nc(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 C21H17NO6 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO6/c1-11-9-17-19(20(24)22-11)14(10-18(23)28-17)16-8-7-15(27-16)12-3-5-13(6-4-12)21(25)26-2/h3-9,14H,10H2,1-2H3,(H,22,24)InChIKey
KXTAUUGIHREALJ-UHFFFAOYSA-NSynonyms
1435986-04-11435986041
CC1=CC2=C(C(CC(=O)O2)C3=CC=C(O3)C4=CC=C(C=C4)C(=O)OC)C(=O)N1
InChI=1SC21H17NO6c11191719(20(24)2211)14(1018(23)2817)168715(2716)123513(6412)21(25)262h3914H10H212H3(H2224)
methyl4(5(5hydroxy7methyl2oxo34dihydro2Hpyrano(32c)pyridin4yl)furan2yl)benzoate
methyl4(5(7methyl25dioxo46dihydro3Hpyrano(32c)pyridin4yl)furan2yl)benzoate
MFCD28026025
ZINC000095473964
ZINC000095473965
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