Vitas-M small molecule compound
(S)-2-(1-((2S,3S)-2-((tert-butoxycarbonyl)amino)-3-methylpentanoyl)piperidine-4-carboxamido)-3-methylbutanoic acid
Catalog ID
STL537787
SMILES CCC([C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)OC(C)(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 C22H39N3O6 MW 441.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H39N3O6/c1-8-14(4)17(24-21(30)31-22(5,6)7)19(27)25-11-9-15(10-12-25)18(26)23-16(13(2)3)20(28)29/h13-17H,8-12H2,1-7H3,(H,23,26)(H,24,30)(H,28,29)/t14?,16-,17-/m0/s1InChIKey
HTBVVKNIEQSHHZ-HGVHAKBWSA-NSynonyms
956974-07-5(2~(S))3methyl2((1((2~(S))3methyl2((2methylpropan2yl)oxycarbonylamino)pentanoyl)piperidine4carbonyl)amino)butanoicacid
(S)2(1((2S3S)2((tertbutoxycarbonyl)amino)3methylpentanoyl)piperidine4carboxamido)3methylbutanoicacid
16400611
956974075
CCC((C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)O)C(C)C)NC(=O)OC(C)(C)C)C
InChI=1SC22H39N3O6c1814(4)17(2421(30)3122(56)7)19(27)2511915(101225)18(26)2316(13(2)3)20(28)29h1317H812H217H3(H2326)(H2430)(H2829)t14?1617m0s1
MFCD05671711
ZINC000008918314
ZINC000012865314
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