Vitas-M small molecule compound

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

Catalog ID
STL002356
SMILES CCC([C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1ccccc1)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 C26H39N3O6 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H39N3O6/c1-6-17(2)21(28-25(34)35-26(3,4)5)23(31)29-14-12-19(13-15-29)22(30)27-20(24(32)33)16-18-10-8-7-9-11-18/h7-11,17,19-21H,6,12-16H2,1-5H3,(H,27,30)(H,28,34)(H,32,33)/t17?,20-,21-/m0/s1
InChIKey
YOZVYYDLDDYBLR-FUKGKQRISA-N
Synonyms
956950-85-9
(2S)2((1((2S)3methyl2((2methylpropan2yl)oxycarbonylamino)pentanoyl)piperidine4carbonyl)amino)3phenylpropanoicacid
(S)2(1((2S3S)2((tertbutoxycarbonyl)amino)3methylpentanoyl)piperidine4carboxamido)3phenylpropanoicacid
956950859
CCC((C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)O)Cc1ccccc1)NC(=O)OC(C)(C)C)C
CCC(C)C(C(=O)N1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O)NC(=O)OC(C)(C)C
InChI=1SC26H39N3O6c1617(2)21(2825(34)3526(34)5)23(31)29141219(131529)22(30)2720(24(32)33)1618108791118h711171921H61216H215H3(H2730)(H2834)(H3233)t17?2021m0s1
MFCD05671951
ZINC000008918375
ZINC000012866061

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Available files

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