Vitas-M small molecule compound

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

Catalog ID
STL536825
SMILES CCC([C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)CC(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 C23H41N3O6 MW 455.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H41N3O6/c1-8-15(4)18(21(29)30)25-19(27)16-9-11-26(12-10-16)20(28)17(13-14(2)3)24-22(31)32-23(5,6)7/h14-18H,8-13H2,1-7H3,(H,24,31)(H,25,27)(H,29,30)/t15?,17-,18-/m0/s1
InChIKey
KUXTWQJTGJXYNM-BEEDKBRMSA-N
Synonyms
956935-49-2
(2~(S))3methyl2((1((2~(S))4methyl2((2methylpropan2yl)oxycarbonylamino)pentanoyl)piperidine4carbonyl)amino)pentanoicacid
(2S3R)2(1((S)2((tertbutoxycarbonyl)amino)4methylpentanoyl)piperidine4carboxamido)3methylpentanoicacid
16399977
956935492
CCC((C@@H)(C(=O)O)NC(=O)C1CCN(CC1)C(=O)(C@@H)(NC(=O)OC(C)(C)C)CC(C)C)C
InChI=1SC23H41N3O6c1815(4)18(21(29)30)2519(27)1691126(121016)20(28)17(1314(2)3)2422(31)3223(56)7h1418H813H217H3(H2431)(H2527)(H2930)t15?1718m0s1
ZINC000008917992
ZINC000012862671

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Available files

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