Vitas-M small molecule compound

3-[(acetyloxy)methyl]-7-[(2-ethylbutanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Catalog ID
STL177492
SMILES CCC(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)C)CC

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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 C16H22N2O6S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O6S/c1-4-9(5-2)13(20)17-11-14(21)18-12(16(22)23)10(6-24-8(3)19)7-25-15(11)18/h9,11,15H,4-7H2,1-3H3,(H,17,20)(H,22,23)
InChIKey
WHTOPMSWCVEVDT-UHFFFAOYSA-N
Synonyms
1214654-83-7
1214654837
3((acetyloxy)methyl)7((2ethylbutanoyl)amino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
3(acetyloxymethyl)7(2ethylbutanoylamino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
CCC(CC)C(=O)NC1C2N(C1=O)C(=C(CS2)COC(=O)C)C(=O)O
InChI=1SC16H22N2O6Sc149(52)13(20)171114(21)1812(16(22)23)10(6248(3)19)72515(11)18h91115H47H213H3(H1720)(H2223)
MFCD04054107
ZINC000006397102
ZINC000006397124

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Available files

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