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

Details

Stereochemistry RACEMIC
Molecular Formula C22H41O5P
Molecular Weight 416.5317
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CARBACYCLIC PHOSPHATIDIC ACID

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)OCC1COP(O)(=O)C1

InChI

InChIKey=PUPWWTUVIZOPTB-KTKRTIGZSA-N
InChI=1S/C22H41O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(23)26-18-21-19-27-28(24,25)20-21/h9-10,21H,2-8,11-20H2,1H3,(H,24,25)/b10-9-

HIDE SMILES / InChI

Molecular Formula C22H41O5P
Molecular Weight 416.5317
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:13:03 GMT 2023
Edited
by admin
on Sat Dec 16 12:13:03 GMT 2023
Record UNII
OXV962AR86
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBACYCLIC PHOSPHATIDIC ACID
Common Name English
4-(((Z)-9-OCTADECENOYLOXY)METHYL)-2-HYDROXY-1,2-OXAPHOSPHOLANE 2-OXIDE
Systematic Name English
9-OCTADECENOIC ACID (9Z)-, (2-HYDROXY-2-OXIDO-1,2-OXAPHOSPHOLAN-4-YL)METHYL ESTER
Systematic Name English
2CCPA
Common Name English
Code System Code Type Description
CAS
633278-53-2
Created by admin on Sat Dec 16 12:13:03 GMT 2023 , Edited by admin on Sat Dec 16 12:13:03 GMT 2023
PRIMARY
CAS
1450911-59-7
Created by admin on Sat Dec 16 12:13:03 GMT 2023 , Edited by admin on Sat Dec 16 12:13:03 GMT 2023
ALTERNATIVE
FDA UNII
OXV962AR86
Created by admin on Sat Dec 16 12:13:03 GMT 2023 , Edited by admin on Sat Dec 16 12:13:03 GMT 2023
PRIMARY
PUBCHEM
71528764
Created by admin on Sat Dec 16 12:13:03 GMT 2023 , Edited by admin on Sat Dec 16 12:13:03 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY