Vitas-M small molecule compound

(S)-2-(1-((2S,3S)-2-((tert-butoxycarbonyl)amino)-3-methylpentanoyl)piperidine-4-carboxamido)propanoic acid

Catalog ID
STL537130
SMILES CCC([C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)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 C20H35N3O6 MW 413.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H35N3O6/c1-7-12(2)15(22-19(28)29-20(4,5)6)17(25)23-10-8-14(9-11-23)16(24)21-13(3)18(26)27/h12-15H,7-11H2,1-6H3,(H,21,24)(H,22,28)(H,26,27)/t12?,13-,15-/m0/s1
InChIKey
PCGHWSZFMSNTBT-MHEXWIEDSA-N
Synonyms
957044-30-3
(2~(S))2((1((2~(S))3methyl2((2methylpropan2yl)oxycarbonylamino)pentanoyl)piperidine4carbonyl)amino)propanoicacid
(S)2(1((2S3S)2((tertbutoxycarbonyl)amino)3methylpentanoyl)piperidine4carboxamido)propanoicacid
16400855
957044303
CCC((C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)O)C)NC(=O)OC(C)(C)C)C
InChI=1SC20H35N3O6c1712(2)15(2219(28)2920(45)6)17(25)2310814(91123)16(24)2113(3)18(26)27h1215H711H216H3(H2124)(H2228)(H2627)t12?1315m0s1
MFCD05672135
ZINC000004073737
ZINC000012866517

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Available files

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