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Details

Stereochemistry ABSOLUTE
Molecular Formula C40H76O10P.H4N
Molecular Weight 766.0377
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AMMONIUM 1-PALMITOYL-2-OLEOYL-SN-GLYCERO-3-(PHOSPHO-R-(1-GLYCEROL))

SMILES

[NH4+].CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OC[C@H](O)CO)OC(=O)CCCCCCC\C=C/CCCCCCCC

InChI

InChIKey=WFYVYFVKHCDATR-METQWREVSA-N
InChI=1S/C40H77O10P.H3N/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2;/h17-18,37-38,41-42H,3-16,19-36H2,1-2H3,(H,45,46);1H3/b18-17-;/t37-,38-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C40H77O10P
Molecular Weight 749.0071
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Molecular Formula H3N
Molecular Weight 17.0305
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:37:58 GMT 2023
Edited
by admin
on Fri Dec 15 15:37:58 GMT 2023
Record UNII
4401DBY0OJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMMONIUM 1-PALMITOYL-2-OLEOYL-SN-GLYCERO-3-(PHOSPHO-R-(1-GLYCEROL))
Common Name English
9-OCTADECENOIC ACID, (1R)-2-(((((2S)-2,3-DIHYDROXYPROPYL)OXY)HYDROXYPHOSPHINYL)OXY)-1-(((1-OXOHEXADECYL)OXY)METHYL)ETHYL ESTER, MONOAMMONIUM SALT, (9Z)-
Common Name English
1-PALMITOYL-2-OLEOYL-SN-GLYCERO-3-(PHOSPHO-R-(1-GLYCEROL)), AMMONIUM SALT
Common Name English
Code System Code Type Description
FDA UNII
4401DBY0OJ
Created by admin on Fri Dec 15 15:37:58 GMT 2023 , Edited by admin on Fri Dec 15 15:37:58 GMT 2023
PRIMARY
CAS
267228-70-6
Created by admin on Fri Dec 15 15:37:58 GMT 2023 , Edited by admin on Fri Dec 15 15:37:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID10746684
Created by admin on Fri Dec 15 15:37:58 GMT 2023 , Edited by admin on Fri Dec 15 15:37:58 GMT 2023
PRIMARY
PUBCHEM
91810644
Created by admin on Fri Dec 15 15:37:58 GMT 2023 , Edited by admin on Fri Dec 15 15:37:58 GMT 2023
PRIMARY