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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H18N2O5.C4H5NO4S
Molecular Weight 457.455
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASPARTAME ACESULFAME

SMILES

CC1=CC(=O)NS(=O)(=O)O1.COC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](N)CC(O)=O

InChI

InChIKey=KVHQNWGLVVERFR-ACMTZBLWSA-N
InChI=1S/C14H18N2O5.C4H5NO4S/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18;1-3-2-4(6)5-10(7,8)9-3/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18);2H,1H3,(H,5,6)/t10-,11-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C4H5NO4S
Molecular Weight 163.152
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C14H18N2O5
Molecular Weight 294.3031
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:57:56 GMT 2023
Edited
by admin
on Fri Dec 15 16:57:56 GMT 2023
Record UNII
IFE6C6BS24
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASPARTAME ACESULFAME
MART.   USP-RS  
Common Name English
TWINSWEET
Brand Name English
E-962
Code English
ASPARTAME ACESULFAME [USP-RS]
Common Name English
SALT OF ASPARTAME-ACESULFAME
Common Name English
ASPARTAME-ACESULFAME SALT
FCC  
Common Name English
L-PHENYLALANINE, L-.ALPHA.-ASPARTYL-2-METHYL ESTER COMPOUND WITH 6-METHYL-1,2,3-OXATHIAZIN-4(3H)-ONE 2,2-DIOXIDE (1:1)
Common Name English
ASPARTAME ACESULFAME [MART.]
Common Name English
APM-ACE
Common Name English
INS NO.962
Code English
ASPARTAME-ACESULFAME SALT [FCC]
Common Name English
(2-CARBOXY--(N-(B-METHOXYCARBONYL-2 PHENYL)ETHYLCARBAMOYL)) ETHANAMINIUM 6-METHYL-4-OXO-1,2,3-OXATHIAZIN-3-IDE-2,2-DIOXIDE
Common Name English
INS-962
Code English
TWINSWEET LA
Common Name English
Classification Tree Code System Code
JECFA EVALUATION E-962
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
CODEX ALIMENTARIUS (GSFA) E-962
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
Code System Code Type Description
CAS
106372-55-8
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID30909991
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
WIKIPEDIA
ASPARTAME-ACESULFAME SALT
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
FDA UNII
IFE6C6BS24
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
RXCUI
1371304
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY RxNorm
RS_ITEM_NUM
1043750
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
DAILYMED
IFE6C6BS24
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
PUBCHEM
10972537
Created by admin on Fri Dec 15 16:57:56 GMT 2023 , Edited by admin on Fri Dec 15 16:57:56 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
ACTIVE MOIETY