Vitas-M small molecule compound

N~2~-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-D-asparagine

Catalog ID
STK586862
SMILES O=C(C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)N[C@@H](C(=O)O)CC(=O)N

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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 C21H29N3O6 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O6/c1-20(2,3)30-19(29)24-11-9-21(10-12-24,14-7-5-4-6-8-14)18(28)23-15(17(26)27)13-16(22)25/h4-8,15H,9-13H2,1-3H3,(H2,22,25)(H,23,28)(H,26,27)/t15-/m1/s1
InChIKey
UACLPYBALYKENK-OAHLLOKOSA-N
Synonyms
1173676-32-8
(2R)4AMINO2((1((2METHYLPROPAN2YL)OXYCARBONYL)4PHENYLPIPERIDINE4CARBONYL)AMINO)4OXOBUTANOICACID
(R)4amino2(1(tertbutoxycarbonyl)4phenylpiperidine4carboxamido)4oxobutanoicacid
1173676328
CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NC(CC(=O)N)C(=O)O
InChI=1SC21H29N3O6c120(23)3019(29)2411921(101224147546814)18(28)2315(17(26)27)1316(22)25h4815H913H213H3(H22225)(H2328)(H2627)t15m1s1
MFCD07639726
N~2~((1(tertbutoxycarbonyl)4phenylpiperidin4yl)carbonyl)Dasparagine
N2((1(TERTBUTOXYCARBONYL)4PHENYLPIPERIDIN4YL)CARBONYL)DASPARAGINE
O=C(C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)N(C@@H)(C(=O)O)CC(=O)N
ZINC000005428387
ZINC5428387

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Available files

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