Doconexent

DHA-FA · HY-17031-25g · Docosahexaenoic Acids · Docosahexaenoic acid(mix) · Docosa-2,4,6,8,10,12-hexaenoic acid · (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid

https://huagongshe.com/de/chemical/445580

Identifikatoren & physikalische Daten

CAS No.	25167-62-8
Summenformel	C22H32O2
Durchschnittliche Molmasse	328,5 g/mol
Monoisotopische Masse	328,24023026 g/mol
SMILES	CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O
InChIKey	MBMBGCFOFBJSGT-KUBAVDMBSA-N
PubChem CID	445580
ChEMBL	CHEMBL367149
ChEBI	CHEBI:28125
EC No.	612-950-9
DTXSID	DTXSID5040465

Chemische & physikalische Eigenschaften

XLogP	6,2
Polarare Oberfläche (TPSA)	37,3
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	14
Schwere Atome	24
Formalladung	0
Komplexität	462
Arzneimittel	Pharmaceuticals -> Listed in ZINC15
Lipide	Lipids -> Unambiguous LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Unsaturated fatty acids [FA0103]
Kosmetika	AntistaticSkin conditioning
SpringerMaterials Properties	Chemical diffusion
Physical Description	Liquid
Collision Cross Section	187.9 Å² [M-H]- [CCS Type: DTBuffer gas: N2Sample Type: Human bronchoalveolar lavage fluid (BALF)Dataset: Unambiguous Lipids]184.62 Å² [M+H]+ [CCS Type: DTMethod: stepped-field]183.5 Å² [M+H]+
Kosmetik-Inhaltsstoffe Funktionen	ANTISTATICSKIN CONDITIONING
InChI	InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h10-21H,2-9H2,1H3,(H,23,24)/b11-10+,13-12+,15-14+,17-16+,19-18+,21-20+
InChIKey	DVSZKTAMJJTWFG-SKCDLICFSA-N
SMILES	C(O)(=O)/C=C/C=C/C=C/C=C/C=C/C=C/CCCCCCCCC
LogP (Verteilungskoeffizient)	7.780 (est)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 98.2% (56 of 57) of all reports.Not ClassifiedAggregated GHS information provided per 57 reports by companies from 2 notifications to the ECHA C&L Inventory.
Regulatorische Informationen	Docosahexaenoic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.4,7,10,13,16,19-Docosahexaenoic acid, (4Z,7Z,10Z,13Z,16Z,19Z)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and Categories	Not Classified
Alarmwort	Warnung
Gefahrenhinweise	Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302

Anwendungen & Verwendung

Beschreibung

Docosahexaenoic acid (DHA) is an omega-3 fatty acid found in cold-water, fatty fish, such as salmon.It is also found in fish oil supplements, along with eicosapentaenoic acid (EPA). Vegetarian sources of DHA come from seaweed. Docosahexaenoic acid (DHA) is essential for the growth and functional development of the brain in infants. DHA is also required for maintenance of normal brain function in adults. The inclusion of plentiful DHA in the diet improves learning ability, whereas deficiencies of DHA are associated with deficits in learning. DHA is taken up by the brain in preference to other fatty acids. The turnover of DHA in the brain is very fast, more so than is generally realized. The visual acuity of healthy, full-term, formula-fed infants is increased when their formula includes DHA[1].