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

Details

Stereochemistry RACEMIC
Molecular Formula C43H72NO6P
Molecular Weight 730.0086
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 7
Charge 0

SHOW SMILES / InChI
Structure of PPI-1040

SMILES

CCCCCCCCCCCCCC\C=C/OCC(COP1(=O)NCCO1)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC

InChI

InChIKey=SKDNPCDRIUQGAL-XTJCVSPVSA-N
InChI=1S/C43H72NO6P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-43(45)50-42(41-49-51(46)44-37-39-48-51)40-47-38-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24,26,30,32,35,38,42H,3-4,6,8-10,12,14-16,18,20,23,25,27-29,31,33-34,36-37,39-41H2,1-2H3,(H,44,46)/b7-5-,13-11-,19-17-,22-21-,26-24-,32-30-,38-35-

HIDE SMILES / InChI

Approval Year

Name Type Language
1-(((Z)-HEXADEC-1-EN-1-YL)OXY)-3-((2-OXIDO-1,3,2-OXAZAPHOSPHOLIDIN-2-YL)OXY)PROPAN-2-YL (4Z,7Z,10Z,13Z,16Z,19Z)-DOCOSA-4,7,10,13,16,19-HEXAENOATE
Preferred Name English
PPI-1040
Code English
4,7,10,13,16,19-DOCOSAHEXAENOIC ACID, 2-((1Z)-1-HEXADECEN-1-YLOXY)-1-(((2-OXIDO-1,3,2-OXAZAPHOSPHOLIDIN-2-YL)OXY)METHYL)ETHYL ESTER, (4Z,7Z,10Z,13Z,16Z,19Z)-
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 696219
Created by admin on Wed Apr 02 07:50:34 GMT 2025 , Edited by admin on Wed Apr 02 07:50:34 GMT 2025
Code System Code Type Description
PUBCHEM
89584363
Created by admin on Wed Apr 02 07:50:34 GMT 2025 , Edited by admin on Wed Apr 02 07:50:34 GMT 2025
PRIMARY
CAS
1436673-69-6
Created by admin on Wed Apr 02 07:50:34 GMT 2025 , Edited by admin on Wed Apr 02 07:50:34 GMT 2025
PRIMARY
SMS_ID
300000044707
Created by admin on Wed Apr 02 07:50:34 GMT 2025 , Edited by admin on Wed Apr 02 07:50:34 GMT 2025
PRIMARY
FDA UNII
5J560A5O35
Created by admin on Wed Apr 02 07:50:34 GMT 2025 , Edited by admin on Wed Apr 02 07:50:34 GMT 2025
PRIMARY