Vitas-M small molecule compound

methyl N-[4-(octan-2-ylamino)-4-oxobutanoyl]phenylalaninate

Catalog ID
STK175501
SMILES CCCCCCC(NC(=O)CCC(=O)NC(C(=O)OC)Cc1ccccc1)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 C22H34N2O4 MW 390.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H34N2O4/c1-4-5-6-8-11-17(2)23-20(25)14-15-21(26)24-19(22(27)28-3)16-18-12-9-7-10-13-18/h7,9-10,12-13,17,19H,4-6,8,11,14-16H2,1-3H3,(H,23,25)(H,24,26)
InChIKey
GVDACQMTVZFPCU-UHFFFAOYSA-N
Synonyms

CCCCCCC(C)NC(=O)CCC(=O)NC(CC1=CC=CC=C1)C(=O)OC
InChI=1SC22H34N2O4c145681117(2)2320(25)141521(26)2419(22(27)283)16181297101318h791012131719H468111416H213H3(H2325)(H2426)
methyl2((4(octan2ylamino)4oxobutanoyl)amino)3phenylpropanoate
METHYLN(4(OCTAN2YLAMINO)4OXOBUTANOYL)PHENYLALANINATE
MFCD08680258
ZINC000004704304
ZINC000004704307

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Available files

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