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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H60NO6P
Molecular Weight 537.7529
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-O-OCTADECYL-2-O-ETHYLGLYCERYL-3-PHOSPHORYLCHOLINE, (S)-

SMILES

CCCCCCCCCCCCCCCCCCOC[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)OCC

InChI

InChIKey=FSHMOCOVNGAJTL-NDEPHWFRSA-N
InChI=1S/C28H60NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-32-26-28(33-7-2)27-35-36(30,31)34-25-23-29(3,4)5/h28H,6-27H2,1-5H3/t28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H60NO6P
Molecular Weight 537.7529
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:37:13 GMT 2023
Edited
by admin
on Sat Dec 16 11:37:13 GMT 2023
Record UNII
E254A4KG25
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-O-OCTADECYL-2-O-ETHYLGLYCERYL-3-PHOSPHORYLCHOLINE, (S)-
Common Name English
3,5,9-TRIOXA-4-PHOSPHAHEPTACOSAN-1-AMINIUM, 7-ETHOXY-4-HYDROXY-N,N,N-TRIMETHYL-, INNER SALT, 4-OXIDE, (S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40933904
Created by admin on Sat Dec 16 11:37:13 GMT 2023 , Edited by admin on Sat Dec 16 11:37:13 GMT 2023
PRIMARY
FDA UNII
E254A4KG25
Created by admin on Sat Dec 16 11:37:13 GMT 2023 , Edited by admin on Sat Dec 16 11:37:13 GMT 2023
PRIMARY
PUBCHEM
24779417
Created by admin on Sat Dec 16 11:37:13 GMT 2023 , Edited by admin on Sat Dec 16 11:37:13 GMT 2023
PRIMARY
CAS
150283-37-7
Created by admin on Sat Dec 16 11:37:13 GMT 2023 , Edited by admin on Sat Dec 16 11:37:13 GMT 2023
PRIMARY