Vitas-M small molecule compound
5-[(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]furan-2-carboxylic acid
Catalog ID
STL367207
SMILES Cc1ccc2c(c1)N(Cc1ccc(o1)C(=O)O)C(=O)CO2
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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 C15H13NO5 MW 287.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO5/c1-9-2-4-12-11(6-9)16(14(17)8-20-12)7-10-3-5-13(21-10)15(18)19/h2-6H,7-8H2,1H3,(H,18,19)InChIKey
CJXFTCLYBAMVHI-UHFFFAOYSA-NSynonyms
5((6methyl3oxo14benzoxazin4yl)methyl)furan2carboxylicacid
5((6methyl3oxo23dihydro4H14benzoxazin4yl)methyl)furan2carboxylicacid
CC1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)O
InChI=1SC15H13NO5c19241211(69)16(14(17)82012)7103513(2110)15(18)19h26H78H21H3(H1819)
MFCD27966497
ZINC000035516845
ZINC35516845
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