(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

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

Structure Search

SMILES

[H][C@]12CN([C@H](C(=O)N[C@@H](C[C@@H]3CCNC3=O)C(=O)OC)[C@@]1([H])C2(C)C)C(=O)[C@@H](NC(=O)C(F)(F)F)C(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

Molecular Formula	C23H33F3N4O6
Molecular Weight	518.5265
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:55:05 GMT 2023` Edited by `admin` on `Sat Dec 16 19:55:05 GMT 2023`
Record UNII	CNY5Q3BW79
Record Status	`Validated (UNII)`
Record Version

Download

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)-

Common Name

English

Code System Code Type Description

PUBCHEM

164158216

Created by admin on Sat Dec 16 19:55:05 GMT 2023 , Edited by admin on Sat Dec 16 19:55:05 GMT 2023

PRIMARY

FDA UNII

CNY5Q3BW79

Created by admin on Sat Dec 16 19:55:05 GMT 2023 , Edited by admin on Sat Dec 16 19:55:05 GMT 2023

PRIMARY

CAS

2755812-57-6

Created by admin on Sat Dec 16 19:55:05 GMT 2023 , Edited by admin on Sat Dec 16 19:55:05 GMT 2023

PRIMARY