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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H40N2O3
Molecular Weight 368.5539
Optical Activity ( - )
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Methyl-2-(1-methylethyl)cyclohexyl (3R)-3-[[[(1S)-1-(aminocarbonyl)propyl]amino]methyl]hexanoate, (1R,2S,5R)-

SMILES

CCC[C@@H](CN[C@@H](CC)C(N)=O)CC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C

InChI

InChIKey=YIXNNNCLIPUFPE-ZSXDVEMLSA-N
InChI=1S/C21H40N2O3/c1-6-8-16(13-23-18(7-2)21(22)25)12-20(24)26-19-11-15(5)9-10-17(19)14(3)4/h14-19,23H,6-13H2,1-5H3,(H2,22,25)/t15-,16-,17+,18+,19-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
5-Methyl-2-(1-methylethyl)cyclohexyl (3R)-3-[[[(1S)-1-(aminocarbonyl)propyl]amino]methyl]hexanoate, (1R,2S,5R)-
Systematic Name English
(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl (3R)-3-[[[(1S)-1-(aminocarbonyl)propyl]amino]methyl]hexanoate
Preferred Name English
Hexanoic acid, 3-[[[(1S)-1-(aminocarbonyl)propyl]amino]methyl]-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester, (3R)-
Systematic Name English
Code System Code Type Description
FDA UNII
8MBV5T5T95
Created by admin on Wed Apr 02 19:23:06 GMT 2025 , Edited by admin on Wed Apr 02 19:23:06 GMT 2025
PRIMARY
PUBCHEM
156516168
Created by admin on Wed Apr 02 19:23:06 GMT 2025 , Edited by admin on Wed Apr 02 19:23:06 GMT 2025
PRIMARY
CAS
2650518-21-9
Created by admin on Wed Apr 02 19:23:06 GMT 2025 , Edited by admin on Wed Apr 02 19:23:06 GMT 2025
PRIMARY