U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H22N2O4
Molecular Weight 306.3569
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2S)-2-((2-MORPHOLINOACETYL)AMINO)-4-PHENYL-BUTANOIC ACID

SMILES

OC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN2CCOCC2

InChI

InChIKey=AHNYHRJIQAYZGZ-AWEZNQCLSA-N
InChI=1S/C16H22N2O4/c19-15(12-18-8-10-22-11-9-18)17-14(16(20)21)7-6-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,17,19)(H,20,21)/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H22N2O4
Molecular Weight 306.3569
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:51:13 GMT 2023
Edited
by admin
on Sat Dec 16 14:51:13 GMT 2023
Record UNII
2R4ADP62TA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S)-2-((2-MORPHOLINOACETYL)AMINO)-4-PHENYL-BUTANOIC ACID
Systematic Name English
CARFILZOMIB METABOLITE M14
Common Name English
BENZENEBUTANOIC ACID, .ALPHA.-((2-(4-MORPHOLINYL)ACETYL)AMINO)-, (.ALPHA.S)-
Systematic Name English
PR-389
Code English
Code System Code Type Description
CAS
1396006-45-3
Created by admin on Sat Dec 16 14:51:13 GMT 2023 , Edited by admin on Sat Dec 16 14:51:13 GMT 2023
PRIMARY
FDA UNII
2R4ADP62TA
Created by admin on Sat Dec 16 14:51:13 GMT 2023 , Edited by admin on Sat Dec 16 14:51:13 GMT 2023
PRIMARY
PUBCHEM
121299208
Created by admin on Sat Dec 16 14:51:13 GMT 2023 , Edited by admin on Sat Dec 16 14:51:13 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MAJOR
PLASMA; URINE