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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H33F3N4O6
Molecular Weight 518.5265
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2S)-N-[[(1R,2S,5S)-6,6-Dimethyl-3-[(2S)-3-methyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-3-azabicyclo[3.1.0]hex-2-yl]carbonyl]-2-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]glycine methyl ester

SMILES

COC(=O)[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@@H]2[C@@H]3[C@H](CN2C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)C3(C)C

InChI

InChIKey=VEQCWTJHCMWGRI-QNILMXGZSA-N
InChI=1S/C23H33F3N4O6/c1-10(2)15(29-21(35)23(24,25)26)19(33)30-9-12-14(22(12,3)4)16(30)18(32)28-13(20(34)36-5)8-11-6-7-27-17(11)31/h10-16H,6-9H2,1-5H3,(H,27,31)(H,28,32)(H,29,35)/t11-,12-,13-,14-,15-,16-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(2S)-N-[[(1R,2S,5S)-6,6-Dimethyl-3-[(2S)-3-methyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-3-azabicyclo[3.1.0]hex-2-yl]carbonyl]-2-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]glycine methyl ester
Systematic Name English
Glycine, N-[[(1R,2S,5S)-6,6-dimethyl-3-[(2S)-3-methyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-3-azabicyclo[3.1.0]hex-2-yl]carbonyl]-2-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]-, methyl ester, (2S)-
Preferred Name English
Code System Code Type Description
PUBCHEM
164158216
Created by admin on Wed Apr 02 17:41:33 GMT 2025 , Edited by admin on Wed Apr 02 17:41:33 GMT 2025
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FDA UNII
CNY5Q3BW79
Created by admin on Wed Apr 02 17:41:33 GMT 2025 , Edited by admin on Wed Apr 02 17:41:33 GMT 2025
PRIMARY
CAS
2755812-57-6
Created by admin on Wed Apr 02 17:41:33 GMT 2025 , Edited by admin on Wed Apr 02 17:41:33 GMT 2025
PRIMARY