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Details

Stereochemistry EPIMERIC
Molecular Formula C22H44N4O3.C5H7NO3
Molecular Weight 541.7237
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PYRROLIDONE CARBOXYLIC ACID ETHYL MYRISTOYL ARGINATE

SMILES

OC(=O)C1CCC(=O)N1.CCCCCCCCCCCCCC(=O)N[C@@H](CCCNC(N)=N)C(=O)OCC

InChI

InChIKey=PZYZNWYVBGZODW-FYZYNONXSA-N
InChI=1S/C22H44N4O3.C5H7NO3/c1-3-5-6-7-8-9-10-11-12-13-14-17-20(27)26-19(21(28)29-4-2)16-15-18-25-22(23)24;7-4-2-1-3(6-4)5(8)9/h19H,3-18H2,1-2H3,(H,26,27)(H4,23,24,25);3H,1-2H2,(H,6,7)(H,8,9)/t19-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C22H44N4O3
Molecular Weight 412.6098
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C5H7NO3
Molecular Weight 129.114
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:58:06 GMT 2023
Edited
by admin
on Sat Dec 16 01:58:06 GMT 2023
Record UNII
GJ0R85854K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PYRROLIDONE CARBOXYLIC ACID ETHYL MYRISTOYL ARGINATE
Common Name English
PCA ETHYL MYRISTOYL ARGINATE
Common Name English
PROLINE, 5-OXO-, COMPD. WITH N2-(1-OXOTETRADECYL)-L-ARGININE ETHYL ESTER (1:1)
Systematic Name English
L-ARGININE, N2-(1-OXOTETRADECYL)-, ETHYL ESTER, COMPD. WITH 5-OXOPROLINE (1:1)
Common Name English
DL-PROLINE, 5-OXO-, COMPD. WITH N2-(1-OXOTETRADECYL)-L-ARGININE ETHYL ESTER (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
6451769
Created by admin on Sat Dec 16 01:58:06 GMT 2023 , Edited by admin on Sat Dec 16 01:58:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
255-452-3
Created by admin on Sat Dec 16 01:58:06 GMT 2023 , Edited by admin on Sat Dec 16 01:58:06 GMT 2023
PRIMARY
CAS
41594-90-5
Created by admin on Sat Dec 16 01:58:06 GMT 2023 , Edited by admin on Sat Dec 16 01:58:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID70961831
Created by admin on Sat Dec 16 01:58:06 GMT 2023 , Edited by admin on Sat Dec 16 01:58:06 GMT 2023
PRIMARY
FDA UNII
GJ0R85854K
Created by admin on Sat Dec 16 01:58:06 GMT 2023 , Edited by admin on Sat Dec 16 01:58:06 GMT 2023
PRIMARY