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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C45H78NO8P
Molecular Weight	792.0765
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	6
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

CCCCCCCCCCCCCCCCCC(=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=BCQUMXPGAAJTET-MMDTYXNTSA-N

InChI=1S/C45H78NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-25-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46)54-45(48)38-36-34-32-30-28-26-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,25,27,31,33,43H,3-4,6,8-10,12,14-16,18,20,23-24,26,28-30,32,34-42,46H2,1-2H3,(H,49,50)/b7-5-,13-11-,19-17-,22-21-,27-25-,33-31-/t43-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C45H78NO8P
Molecular Weight	792.0765
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 `Mon Mar 31 22:26:01 GMT 2025` Edited by `admin` on `Mon Mar 31 22:26:01 GMT 2025`
Record UNII	45LA45375S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Preferred Name

English

1-STEAROYL-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-OXOOCTADECYL)OXY)PROPYL ESTER, (4Z,7Z,10Z,13Z,16Z,19Z)-

Systematic Name

English

Code System Code Type Description

CHEBI

79109