Vitas-M small molecule compound

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

Catalog ID
STL538207
SMILES CCC([C@@H](C(=O)N1CCC(CC1)C(=O)N[C@@H](c1ccccc1)C(=O)O)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 C25H37N3O6 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H37N3O6/c1-6-16(2)19(27-24(33)34-25(3,4)5)22(30)28-14-12-18(13-15-28)21(29)26-20(23(31)32)17-10-8-7-9-11-17/h7-11,16,18-20H,6,12-15H2,1-5H3,(H,26,29)(H,27,33)(H,31,32)/t16?,19-,20-/m0/s1
InChIKey
PICJEQCTODDFRP-RFFXKOPCSA-N
Synonyms
956942-55-5
(2~(S))2((1((2~(S))3methyl2((2methylpropan2yl)oxycarbonylamino)pentanoyl)piperidine4carbonyl)amino)2phenylaceticacid
(S)2(1((2S3S)2((tertbutoxycarbonyl)amino)3methylpentanoyl)piperidine4carboxamido)2phenylaceticacid
16401022
956942555
CCC((C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@@H)(c1ccccc1)C(=O)O)NC(=O)OC(C)(C)C)C
InChI=1SC25H37N3O6c1616(2)19(2724(33)3425(34)5)22(30)28141218(131528)21(29)2620(23(31)32)17108791117h711161820H61215H215H3(H2629)(H2733)(H3132)t16?1920m0s1
MFCD05672407
ZINC000008918510
ZINC000012867195

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.