Vitas-M small molecule compound
2-[(3aR,4R,4aR,7aS,8R,8aR)-3-(4-chlorophenyl)-5,7-dioxo-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindol-6-yl]-4-methylpentanoic acid
Catalog ID
STK587878
SMILES CC(CC(N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)Cl)C(=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 C22H23ClN2O5 MW 430.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O5/c1-9(2)7-14(22(28)29)25-20(26)15-12-8-13(16(15)21(25)27)19-17(12)18(24-30-19)10-3-5-11(23)6-4-10/h3-6,9,12-17,19H,7-8H2,1-2H3,(H,28,29)/t12-,13+,14?,15+,16-,17+,19+/m0/s1InChIKey
CFPGWKCCBMMJHJ-SLSGGPPDSA-NSynonyms
1099596-91-41099596914
2((3aR4R4aR7aS8R8aR)3(4chlorophenyl)57dioxo3a44a577a88aoctahydro6H48methano(12)oxazolo(45f)isoindol6yl)4methylpentanoicacid
2((3aR4R4aR7aS8R8aR)3(4chlorophenyl)57dioxo4a577a88ahexahydro3aH48methanoisoxazolo(45f)isoindol6(4H)yl)4methylpentanoicacid
CC(CC(N1C(=O)(C@H)2(C@@H)(C1=O)(C@@H)1C(C@H)2(C@H)2(C@@H)1ON=C2c1ccc(cc1)Cl)C(=O)O)C
CC(CC(N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)1C(C@@H)2(C@H)2(C@@H)1ON=C2c1ccc(cc1)Cl)C(=O)O)C
MFCD18245823
ZINC000009450012
ZINC000009450016
Check stock
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