Vitas-M small molecule compound
8-methyl-2-oxo-4-propyl-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-isoleucinate
Catalog ID
STL531533
SMILES CCCc1cc(=O)oc2c1ccc(c2C)OC(=O)[C@H]([C@@H](CC)C)NS(=O)(=O)c1ccc(cc1)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 C26H31NO6S MW 485.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO6S/c1-6-8-19-15-23(28)33-25-18(5)22(14-13-21(19)25)32-26(29)24(17(4)7-2)27-34(30,31)20-11-9-16(3)10-12-20/h9-15,17,24,27H,6-8H2,1-5H3/t17-,24+/m1/s1InChIKey
ZJAGEPQKOBQGSW-OSPHWJPCSA-NSynonyms
1173664-22-6(2S3R)8METHYL2OXO4PROPYL2HCHROMEN7YL3METHYL2(4METHYLPHENYLSULFONAMIDO)PENTANOATE
(8methyl2oxo4propylchromen7yl)(2~(S)3~(R))3methyl2((4methylphenyl)sulfonylamino)pentanoate
(8METHYL2OXO4PROPYLCHROMEN7YL)(2S3R)3METHYL2((4METHYLPHENYL)SULFONYLAMINO)PENTANOATE
1173664226
1751227
8methyl2oxo4propyl2Hchromen7ylN((4methylphenyl)sulfonyl)Lisoleucinate
CCCc1cc(=O)oc2c1ccc(c2C)OC(=O)(C@H)((C@@H)(CC)C)NS(=O)(=O)c1ccc(cc1)C
InChI=1SC26H31NO6Sc168191523(28)332518(5)22(141321(19)25)3226(29)24(17(4)72)2734(3031)2011916(3)101220h915172427H68H215H3t1724+m1s1
ZINC000002094569
ZINC2094569
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