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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H25N.C4H4O4
Molecular Weight 335.4379
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AMFEPENTOREX MALEATE, (S)-

SMILES

OC(=O)\C=C/C(O)=O.CCCCCC1=CC=C(C[C@H](C)NC)C=C1

InChI

InChIKey=PVJJINHWTDGWLT-FTUYNFQWSA-N
InChI=1S/C15H25N.C4H4O4/c1-4-5-6-7-14-8-10-15(11-9-14)12-13(2)16-3;5-3(6)1-2-4(7)8/h8-11,13,16H,4-7,12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C15H25N
Molecular Weight 219.3657
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:10:52 GMT 2023
Edited
by admin
on Sat Dec 16 09:10:52 GMT 2023
Record UNII
09H8ZK2US5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMFEPENTOREX MALEATE, (S)-
Common Name English
PHENETHYLAMINE, N,.ALPHA.-DIMETHYL-P-PENTYL-, MALEATE (1:1), (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
90479241
Created by admin on Sat Dec 16 09:10:52 GMT 2023 , Edited by admin on Sat Dec 16 09:10:52 GMT 2023
PRIMARY
FDA UNII
09H8ZK2US5
Created by admin on Sat Dec 16 09:10:52 GMT 2023 , Edited by admin on Sat Dec 16 09:10:52 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER