Vitas-M small molecule compound

methyl N-[5-(cyclohexylamino)-3-methyl-5-oxopentanoyl]phenylalaninate

Catalog ID
STK175533
SMILES COC(=O)C(Cc1ccccc1)NC(=O)CC(CC(=O)NC1CCCCC1)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 C22H32N2O4 MW 388.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O4/c1-16(13-20(25)23-18-11-7-4-8-12-18)14-21(26)24-19(22(27)28-2)15-17-9-5-3-6-10-17/h3,5-6,9-10,16,18-19H,4,7-8,11-15H2,1-2H3,(H,23,25)(H,24,26)
InChIKey
XTWVEXMUEJYYOW-UHFFFAOYSA-N
Synonyms

CC(CC(=O)NC1CCCCC1)CC(=O)NC(CC2=CC=CC=C2)C(=O)OC
InChI=1SC22H32N2O4c116(1320(25)2318117481218)1421(26)2419(22(27)282)151795361017h356910161819H4781115H212H3(H2325)(H2426)
methyl2((5(cyclohexylamino)3methyl5oxopentanoyl)amino)3phenylpropanoate
METHYLN(5(CYCLOHEXYLAMINO)3METHYL5OXOPENTANOYL)PHENYLALANINATE
MFCD08680286
ZINC000004704344
ZINC000004704347

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Available files

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