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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H22N2O4S
Molecular Weight 314.4
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMYLPENICILLIN

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)CCCCC)C(O)=O

InChI

InChIKey=ACAZKHULUUVWCY-JFGNBEQYSA-N
InChI=1S/C14H22N2O4S/c1-4-5-6-7-8(17)15-9-11(18)16-10(13(19)20)14(2,3)21-12(9)16/h9-10,12H,4-7H2,1-3H3,(H,15,17)(H,19,20)/t9-,10+,12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H22N2O4S
Molecular Weight 314.4
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:24:03 GMT 2023
Edited
by admin
on Sat Dec 16 08:24:03 GMT 2023
Record UNII
2891Q2PTF9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMYLPENICILLIN
MI  
Common Name English
(2S,5R,6R)-6-(HEXANOYLAMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID
Systematic Name English
AMYLPENICILLIN [MI]
Common Name English
BENZATHINE BENZYLPENICILLIN IMPURITY I [EP IMPURITY]
Common Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-7-OXO-6-((1-OXOHEXYL)AMINO)-, (2S,5R,6R)-
Systematic Name English
DIHYDROPENICILLIN F
Common Name English
PENICILLIN DF
Common Name English
HEXANOYLPENICILLIN
Common Name English
BENZYLPENICILLIN SODIUM IMPURITY H [EP IMPURITY]
Common Name English
DIHYDRO-PENICILLIN F
Common Name English
BENZYLPENICILLIN POTASSIUM IMPURITY H [EP IMPURITY]
Common Name English
BENZYLPENICILLIN (BENZATHINE) TETRAHYDRATE IMPURITY I [EP IMPURITY]
Common Name English
(2S,5R,6R)-6-HEXANAMIDO-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
CAS
4493-18-9
Created by admin on Sat Dec 16 08:24:03 GMT 2023 , Edited by admin on Sat Dec 16 08:24:03 GMT 2023
PRIMARY
FDA UNII
2891Q2PTF9
Created by admin on Sat Dec 16 08:24:03 GMT 2023 , Edited by admin on Sat Dec 16 08:24:03 GMT 2023
PRIMARY
PUBCHEM
107556
Created by admin on Sat Dec 16 08:24:03 GMT 2023 , Edited by admin on Sat Dec 16 08:24:03 GMT 2023
PRIMARY
MERCK INDEX
m1879
Created by admin on Sat Dec 16 08:24:03 GMT 2023 , Edited by admin on Sat Dec 16 08:24:03 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID80196339
Created by admin on Sat Dec 16 08:24:03 GMT 2023 , Edited by admin on Sat Dec 16 08:24:03 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
ACTIVE MOIETY