6-Methoxy-7-methylquercetin (BioDeep_00000000808)

human metabolite PANOMIX_OTCML-2023 Volatile Flavor Compounds

代谢物信息卡片

4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxy-

化学式: C17H14O8 (346.0688644)
中文名称: 3,5,3’,4’-四羟基-6,7-二甲氧基黄酮
谱图信息: 最多检出来源 Viridiplantae(plant) 4.73%

分子结构信息

SMILES: c1(c(c(c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O)O)OC)OC
InChI: InChI=1S/C17H14O8/c1-23-11-6-10-12(14(21)17(11)24-2)13(20)15(22)16(25-10)7-3-4-8(18)9(19)5-7/h3-6,18-19,21-22H,1-2H3

描述信息

6-methoxy-7-methylquercetin, also known as eupatoletin, is a member of the class of compounds known as flavonols. Flavonols are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position. Thus, 6-methoxy-7-methylquercetin is considered to be a flavonoid lipid molecule. 6-methoxy-7-methylquercetin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 6-methoxy-7-methylquercetin can be found in german camomile, which makes 6-methoxy-7-methylquercetin a potential biomarker for the consumption of this food product.
Eupatolitin is a tetrahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 5, 3 and 4 and methoxy groups at positions 6 and 7 respectively. It is a tetrahydroxyflavone, a dimethoxyflavone and a member of flavonols. It is functionally related to a flavone.
Eupatolitin is a natural product found in Dicoma tomentosa, Haplopappus foliosus, and other organisms with data available.

同义名列表

13 个代谢物同义名

4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxy-; 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxy-4H-1-benzopyran-4-one; 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxy-4H-chromen-4-one; 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxychromen-4-one; FLAVONE, 3,3,4,5-TETRAHYDROXY-6,7-DIMETHOXY-; 3,3,4,5-tetrahydroxy-6,7-dimethoxyflavone; 3,5,3,4-tetrahydroxy-6,7-dimethoxyflavone; 6-Methoxy-7-methylquercetin; UNII-9KB4QHZ4YG; Eupatoletin; Eupatolitin; 9KB4QHZ4YG; Eupatolitin

数据库引用编号

18 个数据库交叉引用编号

ChEBI: CHEBI:81340
KEGG: C17788
PubChem: 5317291
HMDB: HMDB0302731
Metlin: METLIN51406
Wikipedia: Eupatolitin
LipidMAPS: LMPK12112994
ChemIDplus: 0029536445
MetaCyc: CPD-14910
KNApSAcK: C00004688
foodb: FDB005995
chemspider: 4476179
CAS: 29536-44-5
medchemexpress: HY-N10886
PMhub: MS000026089
PubChem: 96024107
NIKKAJI: J94.544G
KNApSAcK: 81340

分类词条

代谢反应

1 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(1)

eupatolitin 3-O-glucoside biosynthesis: SAM + quercetagetin ⟶ H⁺ + SAH + patuletin

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

11 个相关的物种来源信息

2773062 - Ageratina areolaris: 10.1021/NP50043A039
1887443 - Ageratina ligustrina: 10.1016/S0040-4020(01)92863-7
1550814 - Brickellia dentata: 10.1016/0031-9422(80)85136-3
1550823 - Brickellia glutinosa: 10.1021/NP50034A026
1184229 - Dicoma tomentosa: 10.1016/0031-9422(82)83062-8
147773 - Haplopappus foliosus: 10.1021/NP50021A021
9606 - Homo sapiens: -
40742 - Ipomopsis aggregata: 10.1016/S0031-9422(00)97361-8
40743 - Ipomopsis polycladon: 10.1016/0305-1978(85)90072-9
493314 - Loeseliastrum depressum: 10.1016/0305-1978(85)90072-9
711056 - Rudbeckia hirta var. pulcherrima: 10.1021/NP50037A048

在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：

PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。

点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。

文献列表

James D Adams, Cecilia Garcia. Women's health among the Chumash. Evidence-based complementary and alternative medicine : eCAM. 2006 Mar; 3(1):125-31. doi: 10.1093/ecam/nek021. [PMID: 16550233]