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

Approval Year

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 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID3067734
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
CAS
32954-43-1
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
FDA UNII
WP8C6WF33S
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
ECHA (EC/EINECS)
251-306-8
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
PUBCHEM
72096
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
INN
2964
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
ChEMBL
CHEMBL2105283
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
SMS_ID
100000082498
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
EVMPD
SUB09662MIG
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY
NCI_THESAURUS
C66338
Created by admin on Fri Dec 15 15:50:38 UTC 2023 , Edited by admin on Fri Dec 15 15:50:38 UTC 2023
PRIMARY