Vitas-M small molecule compound
3-[(acetyloxy)methyl]-7-[({5-[(2-methylphenoxy)methyl]furan-2-yl}carbonyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STK256707
SMILES CC(=O)OCC1=C(C(=O)O)N2C(SC1)C(C2=O)NC(=O)c1ccc(o1)COc1ccccc1C
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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 C23H22N2O8S MW 486.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O8S/c1-12-5-3-4-6-16(12)32-10-15-7-8-17(33-15)20(27)24-18-21(28)25-19(23(29)30)14(9-31-13(2)26)11-34-22(18)25/h3-8,18,22H,9-11H2,1-2H3,(H,24,27)(H,29,30)InChIKey
PESZUDCGCBVAIY-UHFFFAOYSA-NSynonyms
1214004-37-11214004371
3((acetyloxy)methyl)7(((5((2methylphenoxy)methyl)furan2yl)carbonyl)amino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
3(ACETYLOXYMETHYL)7((5((2METHYLPHENOXY)METHYL)FURAN2CARBONYL)AMINO)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CC1=CC=CC=C1OCC2=CC=C(O2)C(=O)NC3C4N(C3=O)C(=C(CS4)COC(=O)C)C(=O)O
InChI=1SC23H22N2O8Sc112534616(12)3210157817(3315)20(27)241821(28)2519(23(29)30)14(93113(2)26)113422(18)25h381822H911H212H3(H2427)(H2930)
MFCD04052852
ZINC000008927971
ZINC000008927976
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