Vitas-M small molecule compound
3-[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]propanoate
Catalog ID
STK004869
SMILES CCOC(=O)c1[nH]c(c(c1C)CCC(=O)[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 C12H16NO4 MW 238.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17NO4/c1-4-17-12(16)11-7(2)9(8(3)13-11)5-6-10(14)15/h13H,4-6H2,1-3H3,(H,14,15)/p-1InChIKey
CUMYMXCUGHBKLV-UHFFFAOYSA-MSynonyms
3(5(ETHOXYCARBONYL)24DIMETHYL1HPYRROL3YL)PROPANOATE
3(5ETHOXYCARBONYL24DIMETHYL1HPYRROL3YL)PROPANOATE
3(5ETHOXYCARBONYL24DIMETHYL1HPYRROL3YL)PROPIONICACIDANION
CCOC(=O)c1(nH)c(c(c1C)CCC(=O)(O))C
CCOC(=O)c1(nH)c(c(c1C)CCC(=O)(O))C(Na+)
CCOC(=O)C1=C(C(=C(N1)C)CCC(=O)(O))C
InChI=1SC12H17NO4c141712(16)117(2)9(8(3)1311)5610(14)15h13H46H213H3(H1415)p1
MFCD01119104
sodium3(5(ethoxycarbonyl)24dimethyl1Hpyrrol3yl)propanoate
STK004869
ZINC000000179374
ZINC00179374
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