Vitas-M small molecule compound
(R)-2-((1S,4R)-4-(((2S,3R)-2-((tert-butoxycarbonyl)amino)-3-methylpentanamido)methyl)cyclohexanecarboxamido)-4-(methylthio)butanoic acid
Catalog ID
STL530201
SMILES CSCC[C@H](C(=O)O)NC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)[C@H](C(CC)C)NC(=O)OC(C)(C)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 C24H43N3O6S MW 501.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H43N3O6S/c1-7-15(2)19(27-23(32)33-24(3,4)5)21(29)25-14-16-8-10-17(11-9-16)20(28)26-18(22(30)31)12-13-34-6/h15-19H,7-14H2,1-6H3,(H,25,29)(H,26,28)(H,27,32)(H,30,31)/t15?,16-,17-,18-,19+/m1/s1InChIKey
ZGCNXNXIDVOLGB-MFXPGESHSA-NSynonyms
(S)2((1S4S)4(((2S3R)2((tertbutoxycarbonyl)amino)3methylpentanamido)methyl)cyclohexanecarboxamido)4(methylthio)butanoicacid
CSCC(C@@H)(C(=O)O)NC(=O)(C@@H)1CC(C@H)(CC1)CNC(=O)(C@H)(C(CC)C)NC(=O)OC(C)(C)C
InChI=1SC24H43N3O6Sc1715(2)19(2723(32)3324(34)5)21(29)25141681017(11916)20(28)2618(22(30)31)1213346h1519H714H216H3(H2529)(H2628)(H2732)(H3031)t15?16171819+m1s1
MFCD06767884
ZINC000252695387
ZINC000252695388
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