Vitas-M small molecule compound
3-[3-acetyl-4-hydroxy-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Catalog ID
STL002310
SMILES OC(=O)CCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)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 C15H14N2O7 MW 334.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O7/c1-8(18)12-13(9-3-2-4-10(7-9)17(23)24)16(6-5-11(19)20)15(22)14(12)21/h2-4,7,13,21H,5-6H2,1H3,(H,19,20)InChIKey
UHGPHMMVFKSICR-UHFFFAOYSA-NSynonyms
442522-03-43(3acetyl4hydroxy2(3nitrophenyl)5oxo25dihydro1Hpyrrol1yl)propanoicacid
3(3ACETYL4HYDROXY2(3NITROPHENYL)5OXO2HPYRROL1YL)PROPANOICACID
442522034
CC(=O)C1=C(C(=O)N(C1C2=CC(=CC=C2)(N+)(=O)(O))CCC(=O)O)O
InChI=1SC15H14N2O7c18(18)1213(932410(79)17(23)24)16(6511(19)20)15(22)14(12)21h2471321H56H21H3(H1920)
MFCD02159084
OC(=O)CCN1C(c2cccc(c2)(N+)(=O)(O))C(=C(C1=O)O)C(=O)C
ZINC000018176928
ZINC000020101720
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