7-((6-Deoxy-alpha-L-mannopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4H-1-benzopyran-4-one

HCID 442617
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基本情報

CAS
35682-55-4
標準SMILES
COc1c(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c1O
InChIKey
UXCXDWDJBSJZOU-CKPDRDNLSA-N
分子式
C22H22O11
平均分子量
462.4 g/mol
単同位体質量
462.11621151

概要

6-methoxyluteolin 7-alpha-L-rhamnoside is a glycosyloxyflavone that is luteolin substituted by a methoxy group at position 6 and an alpha-L-rhamnosyl moiety at position 7 via a glycosidic linkage. It is a monomethoxyflavone, a trihydroxyflavone, an alpha-L-rhamnoside, a glycosyloxyflavone and a monosaccharide derivative. It is functionally related to a luteolin.

名称と識別子

優先名称
7-((6-Deoxy-alpha-L-mannopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4H-1-benzopyran-4-one
IUPAC
2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one

名称と別名

6-Methoxyluteolin 7-rhamnoside35682-55-4DTXSID60331882RefChem:1074300DTXCID102829762-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-7-((2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one7-((6-Deoxy-alpha-L-mannopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4H-1-benzopyran-4-one6-methoxyluteolin 7-alpha-L-rhamnoside2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-4H-chromen-7-yl 6-deoxy-alpha-L-mannopyranosideCHEBI:28314LMPK12111174
名称をさらに表示
Q271036312-(3,4-Dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-7-yl 6-deoxy-alpha-L-mannopyranoside

データベース識別子

CAS
35682-55-4
PubChem CID
442617
DTXSID
DTXSID60331882
ChEBI
CHEBI:28314
Nikkaji
J2.771.703I

物性

構造計算による物性

XLogP
1
極性表面積
175 Ų
水素結合供与体数
6
水素結合受容体数
11
回転可能結合数
4
重原子数
33

実験および物理化学的性質

LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]

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