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Vitas-M small molecule compound

N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-L-leucyl-L-asparagine

Catalog ID
STK588497
SMILES CC(C[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)N)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 C27H40N4O7 MW 532.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N4O7/c1-17(2)15-19(22(33)29-20(23(34)35)16-21(28)32)30-24(36)27(18-9-7-6-8-10-18)11-13-31(14-12-27)25(37)38-26(3,4)5/h6-10,17,19-20H,11-16H2,1-5H3,(H2,28,32)(H,29,33)(H,30,36)(H,34,35)/t19-,20-/m0/s1
InChIKey
ZLJVGMIKODMOQL-PMACEKPBSA-N
Synonyms
1014042-33-1
(2S)4amino2(((2S)4methyl2((1((2methylpropan2yl)oxycarbonyl)4phenylpiperidine4carbonyl)amino)pentanoyl)amino)4oxobutanoicacid
(R)4amino2((S)2(1(tertbutoxycarbonyl)4phenylpiperidine4carboxamido)4methylpentanamido)4oxobutanoicacid
1014042331
CC(C(C@@H)(C(=O)N(C@@H)(C(=O)O)CC(=O)N)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C
CC(C(C@@H)(C(=O)N(C@H)(C(=O)O)CC(=O)N)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C
CC(C)CC(C(=O)NC(CC(=O)N)C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)C2=CC=CC=C2
InChI=1SC27H40N4O7c117(2)1519(22(33)2920(23(34)35)1621(28)32)3024(36)27(1897681018)111331(141227)25(37)3826(34)5h610171920H1116H215H3(H22832)(H2933)(H3036)(H3435)t1920m0s1
MFCD07638274
N((1(tertbutoxycarbonyl)4phenylpiperidin4yl)carbonyl)LleucylLasparagine
ZINC000013576583
ZINC13576583

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Available files

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