Vitas-M small molecule compound
3-[(acetyloxy)methyl]-7-{[(5-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}furan-2-yl)carbonyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STK384795
SMILES CC(=O)OCC1=C(C(=O)O)N2C(SC1)C(C2=O)NC(=O)c1ccc(o1)COc1cc(C)c(cc1C(C)C)Cl
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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 C26H27ClN2O8S MW 563.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27ClN2O8S/c1-12(2)17-8-18(27)13(3)7-20(17)36-10-16-5-6-19(37-16)23(31)28-21-24(32)29-22(26(33)34)15(9-35-14(4)30)11-38-25(21)29/h5-8,12,21,25H,9-11H2,1-4H3,(H,28,31)(H,33,34)InChIKey
KJTYHADBPJJJNZ-UHFFFAOYSA-NSynonyms
1214173-02-01214173020
3((ACETYLOXY)METHYL)7(((5((4CHLORO5METHYL2(1METHYLETHYL)PHENOXY)METHYL)FURAN2YL)CARBONYL)AMINO)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
3((acetyloxy)methyl)7(((5((4chloro5methyl2(propan2yl)phenoxy)methyl)furan2yl)carbonyl)amino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
3(ACETYLOXYMETHYL)7((5((4CHLORO5METHYL2PROPAN2YLPHENOXY)METHYL)FURAN2CARBONYL)AMINO)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CC1=CC(=C(C=C1Cl)C(C)C)OCC2=CC=C(O2)C(=O)NC3C4N(C3=O)C(=C(CS4)COC(=O)C)C(=O)O
InChI=1SC26H27ClN2O8Sc112(2)17818(27)13(3)720(17)3610165619(3716)23(31)282124(32)2922(26(33)34)15(93514(4)30)113825(21)29h58122125H911H214H3(H2831)(H3334)
MFCD04052857
ZINC000097966054
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.