PANTHENYL DOCOSAHEXAENOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H49NO5
Molecular Weight	515.7245
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	6
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCC(=O)OCCCNC(=O)[C@H](O)C(C)(C)CO

InChI

InChIKey=INCJJTIYMJMAEP-HTGXZGLSSA-N

InChI=1S/C31H49NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-28(34)37-26-23-25-32-30(36)29(35)31(2,3)27-33/h5-6,8-9,11-12,14-15,17-18,20-21,29,33,35H,4,7,10,13,16,19,22-27H2,1-3H3,(H,32,36)/b6-5-,9-8-,12-11-,15-14-,18-17-,21-20-/t29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H49NO5
Molecular Weight	515.7245
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 `Wed Apr 02 12:03:38 GMT 2025` Edited by `admin` on `Wed Apr 02 12:03:38 GMT 2025`
Record UNII	QQ6NSJ52NE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DOCOSAHEXAENOIC ACID PANTHENYL ESTER

Preferred Name

English

PANTHENYL DOCOSAHEXAENOATE

Common Name

English

4,7,10,13,16,19-DOCOSAHEXAENOIC ACID, 3-(((2R)-2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)AMINO)PROPYL ESTER, (4Z,7Z,10Z,13Z,16Z,19Z)-

Systematic Name

English

3-(((2R)-2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)AMINO)PROPYL (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-DOCOSAHEXAENOATE

Systematic Name

English

PANTHENYL ESTER OF DHA

Common Name

English

(4Z,7Z,10Z,13Z,16Z,19Z)-3-((R)-2,4-DIHYDROXY-3,3-DIMTHYLBUTANAMIDO) PROPYL DOCOSA-4,7,10,13,16,19-HEXAENOATE

Systematic Name

English

F373280

Common Name

English

Code System Code Type Description

CAS

1267597-07-8

Created by admin on Wed Apr 02 12:03:38 GMT 2025 , Edited by admin on Wed Apr 02 12:03:38 GMT 2025

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SMS_ID

100000181232

Created by admin on Wed Apr 02 12:03:38 GMT 2025 , Edited by admin on Wed Apr 02 12:03:38 GMT 2025

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FDA UNII

QQ6NSJ52NE

Created by admin on Wed Apr 02 12:03:38 GMT 2025 , Edited by admin on Wed Apr 02 12:03:38 GMT 2025

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PUBCHEM

140609103

Created by admin on Wed Apr 02 12:03:38 GMT 2025 , Edited by admin on Wed Apr 02 12:03:38 GMT 2025

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