Vitas-M small molecule compound

N-({1-[N-(tert-butoxycarbonyl)-L-phenylalanyl]piperidin-4-yl}carbonyl)-L-valine

Catalog ID
STK586388
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccccc1

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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/c1-16(2)20(23(31)32)27-21(29)18-11-13-28(14-12-18)22(30)19(15-17-9-7-6-8-10-17)26-24(33)34-25(3,4)5/h6-10,16,18-20H,11-15H2,1-5H3,(H,26,33)(H,27,29)(H,31,32)/t19-,20-/m0/s1
InChIKey
PDCJMWPEDDKTJB-PMACEKPBSA-N
Synonyms
1013869-32-3
(2S)3methyl2((1((2S)2((2methylpropan2yl)oxycarbonylamino)3phenylpropanoyl)piperidine4carbonyl)amino)butanoicacid
(S)2(1((S)2((tertbutoxycarbonyl)amino)3phenylpropanoyl)piperidine4carboxamido)3methylbutanoicacid
1013869323
CC(C)C(C(=O)O)NC(=O)C1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C
InChI=1SC25H37N3O6c116(2)20(23(31)32)2721(29)18111328(141218)22(30)19(151797681017)2624(33)3425(34)5h610161820H1115H215H3(H2633)(H2729)(H3132)t1920m0s1
MFCD04185164
N((1(N(tertbutoxycarbonyl)Lphenylalanyl)piperidin4yl)carbonyl)Lvaline
O=C(OC(C)(C)C)N(C@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)O)C(C)C)Cc1ccccc1
ZINC000013777638
ZINC13777638

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Available files

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