Aureusin
Grundinformationen
- CAS
633-15-8- Standard-SMILES
O=C1/C(=C/c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21- InChIKey
AMJCTDBATIKENQ-YRDFTBLNSA-N- Summenformel
- C21H20O11
- Durchschnittliche Molmasse
- 448,4 g/mol
- Monoisotopische Masse
- 448,10056145
Überblick
Aureusidin 6-O-beta-glucoside is a beta-D-glucoside in which a beta-D-glucopyranosyl residue is attached at position 6 of aureusidin via a glycosidic linkage. It is a beta-D-glucoside and a hydroxyaurone. It is functionally related to an aureusidin.
Namen und Bezeichner
- Bevorzugter Name
- Aureusin
- IUPAC
- (2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-4-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-3-one
- Englischer Name
- 2-[(Z)-(3,4-Dihydroxyphenyl)methylene]-4-hydroxy-6-(β-D-glucopyranosyloxy)-3(2H)-benzofuranone
- Summenformel
- C21H20O11
- Molmasse
- 448.38
Namen und Synonyme
Aureusidin 6-O-glucoside633-15-8aureusidin 6-O-beta-D-glucosideAureusin2-((3,4-Dihydroxyphenyl)methylene)-6-(beta-D-glucopyranosyloxy)-4-hydroxy-3(2H)-benzofuranoneDTXSID101319150RefChem:1077354DTXCID9017485792-((3,4-dihydroxyphenyl)methylidene)-4-hydroxy-6-((2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-1-benzofuran-3-oneaureusidin 6-O-beta-glucosideCHEMBL2417912(2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-4-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-3-one
Weitere Namen anzeigen
2-[(Z)-(3,4-Dihydroxyphenyl)methylene]-6-(β-D-glucopyranosyloxy)-4-hydroxy-3(2H)-benzofuranone2-[(Z)-(3,4-Dihydroxyphenyl)methylene]-4-hydroxy-6-(β-D-glucopyranosyloxy)-3(2H)-benzofuranone3(2H)-Benzofuranone, 2-[(3,4-dihydroxyphenyl)methylene]-6-(β-D-glucopyranosyloxy)-4-hydroxy-, (2Z)-
(2Z)-2-(3,4-dihydroxybenzylidene)-4-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-6-yl beta-D-glucopyranosideCHEBI:66905BDBM504394903(2H)-Benzofuranone, 2-((3,4-dihydroxyphenyl)methylene)-6-(beta-D-glucopyranosyloxy)-4-hydroxy-, (2Z)-Q27135500(2Z)-2-[(3,4-Dihydroxyphenyl)methylidene]-4-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-6-yl beta-D-glucopyranoside
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,9
- Polarare Oberfläche (TPSA)
- 186 Ų
- H-Brücken-Donoren
- 7
- H-Brücken-Akzeptoren
- 11
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 32
- Formalladung
- 0
- Komplexität
- 714
Chemie und Industrie
Ergänzende Hinweise
DefinitionChEBI: A beta-D-glucoside in which a beta-D-glucopyranosyl residue is attached at position 6 of aureusidin via a glycosidic linkage.
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