pelargonidin-3-O-beta-D-glucoside (BioDeep_00000871908)

human metabolite natural product

代谢物信息卡片

5-hydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7H-chromen-7-one

化学式: C21H20O10 (432.105642)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C1=CC(=CC=C1C2=C(C=C3C(=CC(=O)C=C3O2)O)OC4C(C(C(C(O4)CO)O)O)O)O
InChI: InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-23,25-28H,8H2/t16-,17-,18+,19-,21-/m1/s1

描述信息

Pelargonidin-3-o-beta-d-glucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Pelargonidin-3-o-beta-d-glucoside can be found in a number of food items such as tea leaf willow, carob, sour cherry, and black cabbage, which makes pelargonidin-3-o-beta-d-glucoside a potential biomarker for the consumption of these food products.
Pelargonidin-3-o-β-d-glucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Pelargonidin-3-o-β-d-glucoside can be found in a number of food items such as tea leaf willow, carob, sour cherry, and black cabbage, which makes pelargonidin-3-o-β-d-glucoside a potential biomarker for the consumption of these food products.

同义名列表

4 个代谢物同义名

5-hydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7H-chromen-7-one; 5-hydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-7-one; pelargonidin-3-O-beta-D-glucoside; pelargonidin-3-O-β-D-glucoside

数据库引用编号

6 个数据库交叉引用编号

ChEBI: CHEBI:144778
PubChem: 443649
HMDB: HMDB0304457
foodb: FDB031096
chemspider: 59696638
LOTUS: LTS0103335

分类词条

Anthocyanidins

代谢反应

0 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

33 个相关的物种来源信息

40552 - Asparagaceae: LTS0103335
53866 - Desmodium: LTS0103335
2759 - Eukaryota: LTS0103335
3803 - Fabaceae: LTS0103335
3746 - Fragaria: LTS0103335
57918 - Fragaria vesca: 10.1002/MRC.1260311104
57918 - Fragaria vesca: LTS0103335
3747 - Fragaria × ananassa: 10.1002/(SICI)1099-1565(199811/12)9:6<274::AID-PCA416>3.0.CO;2-G
9606 - Homo sapiens: -
44985 - Hyacinthaceae: LTS0103335
82024 - Hyacinthus: LTS0103335
82025 - Hyacinthus orientalis: 10.1016/0031-9422(95)00140-3
82025 - Hyacinthus orientalis: LTS0103335
271790 - Lablab: LTS0103335
35936 - Lablab purpureus: 10.1271/BBB.60.589
35936 - Lablab purpureus: LTS0103335
4447 - Liliopsida: LTS0103335
3928 - Lythraceae: LTS0103335
3398 - Magnoliopsida: LTS0103335
3883 - Phaseolus: LTS0103335
3885 - Phaseolus vulgaris: 10.1016/0006-2952(96)00421-2
3885 - Phaseolus vulgaris: 10.1021/JF00038A004
3885 - Phaseolus vulgaris: LTS0103335
22662 - Punica: LTS0103335
22663 - Punica granatum: 10.1007/BF02273936
22663 - Punica granatum: LTS0103335
3745 - Rosaceae: LTS0103335
35493 - Streptophyta: LTS0103335
58023 - Tracheophyta: LTS0103335
3913 - Vigna: LTS0103335
3917 - Vigna unguiculata: LTS0103335
3920 - Vigna unguiculata subsp. unguiculata: LTS0103335
33090 - Viridiplantae: LTS0103335

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

T W Burns, P E Langley, G A Robison. Site of free-fatty-acid inhibition of lipolysis by human adipocytes. Metabolism: clinical and experimental. 1975 Mar; 24(3):265-76. doi: 10.1016/0026-0495(75)90108-0. [PMID: 165350]