Vitas-M small molecule compound
(2S,3S)-2-(1-((S)-2-((tert-butoxycarbonyl)amino)-4-methylpentanoyl)piperidine-4-carboxamido)-3-hydroxybutanoic acid
Catalog ID
STL538705
SMILES CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)C(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 C21H37N3O7 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H37N3O7/c1-12(2)11-15(22-20(30)31-21(4,5)6)18(27)24-9-7-14(8-10-24)17(26)23-16(13(3)25)19(28)29/h12-16,25H,7-11H2,1-6H3,(H,22,30)(H,23,26)(H,28,29)/t13?,15-,16-/m0/s1InChIKey
DSYKOLXYZDJCGD-FMYDAXTQSA-NSynonyms
956946-06-8(2~(S))3hydroxy2((1((2~(S))4methyl2((2methylpropan2yl)oxycarbonylamino)pentanoyl)piperidine4carbonyl)amino)butanoicacid
(2S3S)2(1((S)2((tertbutoxycarbonyl)amino)4methylpentanoyl)piperidine4carboxamido)3hydroxybutanoicacid
16400858
956946068
CC(C(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)O)C(O)C)NC(=O)OC(C)(C)C)C
InChI=1SC21H37N3O7c112(2)1115(2220(30)3121(45)6)18(27)249714(81024)17(26)2316(13(3)25)19(28)29h121625H711H216H3(H2230)(H2326)(H2829)t13?1516m0s1
MFCD05672143
ZINC000012866560
ZINC000012866567
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