9,10-Epoxy-18-hydroxyoctadecanoic acid

HCID 9818312CAS 3233-92-9

Grundinformationen

Standard-SMILES
O=C(O)CCCCCCCC1OC1CCCCCCCCO
InChIKey
ITTPZDMHCNGAGQ-UHFFFAOYSA-N
Summenformel
C18H34O4
Durchschnittliche Molmasse
314,5 g/mol
Monoisotopische Masse
314,24570957

Überblick

9,10-epoxy-18-hydroxyoctadecanoic acid is an epoxy fatty acid that is 9,10-epoxyoctadecanoic acid (9,10-epoxystearic acid) carrying an additional hydroxy substituent at position 18. It has a role as a plant metabolite. It is an omega-hydroxy-long-chain fatty acid, a hydroxyoctadecanoic acid and an epoxy fatty acid. It is functionally related to a 9,10-epoxyoctadecanoic acid. It is a conjugate acid of a 9,10-epoxy-18-hydroxyoctadecanoate.

Namen und Bezeichner

Bevorzugter Name
9,10-Epoxy-18-hydroxyoctadecanoic acid
IUPAC
8-[3-(8-hydroxyoctyl)oxiran-2-yl]octanoic acid

Namen und Synonyme

9,10-epoxy-18-hydroxyoctadecanoic acid8-[3-(8-hydroxyoctyl)oxiran-2-yl]octanoic Acid3233-92-9CHEBI:133381DTXSID004312948-(3-(8-hydroxyoctyl)oxiran-2-yl)octanoic acidRefChem:107522DTXCID50382126SCHEMBL320497ITTPZDMHCNGAGQ-UHFFFAOYSA-N9,10-epoxy-18-hydroxystearic acid9,10-epoxy-18-hydroxy-octadecanoic acid
Weitere Namen anzeigen
C19620

Datenbank-Bezeichner

CAS
3233-92-9
PubChem CID
9818312
DTXSID
DTXSID00431294
ChEBI
CHEBI:133381
Nikkaji
J1.039.051F

Eigenschaften

Berechnete Struktureigenschaften

XLogP
4,5
Polarare Oberfläche (TPSA)
70,1 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
16
Schwere Atome
22

Zugehörige Reaktionen

7

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