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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H46N2O3
Molecular Weight 398.6229
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENDECAMAINE

SMILES

CCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC([O-])=O

InChI

InChIKey=OTKWLUKIHNEGIG-UHFFFAOYSA-N
InChI=1S/C23H46N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-22(26)24-19-17-20-25(2,3)21-23(27)28/h4-21H2,1-3H3,(H-,24,26,27,28)

HIDE SMILES / InChI

Molecular Formula C23H46N2O3
Molecular Weight 398.6229
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Pendecamaine, a zwitterionic agent that was used as an ampholytic surface-active agent in surgical scrubs and in cosmetic and toilet preparations. Information about the current use of this drug is not available.

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:50:38 GMT 2023
Edited
by admin
on Fri Dec 15 15:50:38 GMT 2023
Record UNII
WP8C6WF33S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENDECAMAINE
INN   MART.  
INN  
Official Name English
PENDECAMAINE [MART.]
Common Name English
pendecamaine [INN]
Common Name English
PALMITAMIDOPROPYL BETAINE
INCI  
INCI  
Official Name English
PALMITAMIDOPROPYL BETAINE [INCI]
Common Name English
1-PROPANAMINIUM, N-(CARBOXYMETHYL)-N,N-DIMETHYL-3-((1-OXOHEXADECYL)AMINO)-, INNER SALT
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C83486
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID3067734
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
CAS
32954-43-1
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
FDA UNII
WP8C6WF33S
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
ECHA (EC/EINECS)
251-306-8
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
PUBCHEM
72096
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
INN
2964
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
ChEMBL
CHEMBL2105283
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
SMS_ID
100000082498
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
EVMPD
SUB09662MIG
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
NCI_THESAURUS
C66338
Created by admin on Fri Dec 15 15:50:38 GMT 2023 , Edited by admin on Fri Dec 15 15:50:38 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY