Vitas-M small molecule compound

N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}isoleucine

Catalog ID
STL151382
SMILES CCC(C(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)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 C23H34N2O5 MW 418.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N2O5/c1-6-16(2)18(19(26)27)24-20(28)23(17-10-8-7-9-11-17)12-14-25(15-13-23)21(29)30-22(3,4)5/h7-11,16,18H,6,12-15H2,1-5H3,(H,24,28)(H,26,27)
InChIKey
BOPYJAZVGBWPOQ-UHFFFAOYSA-N
Synonyms

(2S3R)2(1(tertbutoxycarbonyl)4phenylpiperidine4carboxamido)3methylpentanoicacid
3METHYL2((1((2METHYLPROPAN2YL)OXYCARBONYL)4PHENYLPIPERIDINE4CARBONYL)AMINO)PENTANOICACID
CCC((C@@H)(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C
CCC(C)C(C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)C2=CC=CC=C2
InChI=1SC23H34N2O5c1616(2)18(19(26)27)2420(28)23(17108791117)121425(151323)21(29)3022(34)5h7111618H61215H215H3(H2428)(H2627)
MFCD20756013
N((1(tertbutoxycarbonyl)4phenylpiperidin4yl)carbonyl)isoleucine
ZINC000005390725
ZINC000008481401

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Available files

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