1-PALMITOYL-2-DOCOSAHEXANOYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C43H74NO8P
Molecular Weight	764.0233
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	6
Charge	0

SHOW SMILES / InChI

Structure of 1-PALMITOYL-2-DOCOSAHEXANOYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE

Structure Search

SMILES

CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)COP(O)(=O)OCCN

InChI

InChIKey=CNFOLWFURRWWGX-HHXXILGKSA-N

InChI=1S/C43H74NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44)52-43(46)36-34-32-30-28-26-23-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,24-25,29,31,41H,3-4,6,8-10,12,14-16,19,22-23,26-28,30,32-40,44H2,1-2H3,(H,47,48)/b7-5-,13-11-,18-17-,21-20-,25-24-,31-29-/t41-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C43H74NO8P
Molecular Weight	764.0233
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	6
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:00:06 GMT 2023` Edited by `admin` on `Sat Dec 16 09:00:06 GMT 2023`
Record UNII	KN1F374H2K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-PALMITOYL-2-DOCOSAHEXANOYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE

Common Name

English

4,7,10,13,16,19-DOCOSAHEXAENOIC ACID, (2R)-3-(((2-AMINOETHOXY)HYDROXYPHOSPHINYL)OXY)-2-((1-OXOHEXADECYL)OXY)PROPYL ESTER, (4Z,7Z,10Z,13Z,16Z,19Z)-

Systematic Name

English

1-HEXADECANOYL-2-DOCOSAHEXANOYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID001102102