Hydroxymethyl indol-3-yl ketone (BioDeep_00000026103)

Secondary id: BioDeep_00000622058, BioDeep_00001871919

human metabolite

代谢物信息卡片

2-Hydroxy-1-(1H-indol-3-yl)ethanone, 9ci

化学式: C10H9NO2 (175.0633254)
中文名称: 2-羟基-1-(1H-吲哚-3-基)乙酮
谱图信息: 最多检出来源 Lycium chinense(natural_products) 0.89%

分子结构信息

SMILES: C1=CC=C2C(=C1)C(=CN2)C(=O)CO
InChI: InChI=1S/C10H9NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-5,11-12H,6H2

描述信息

Hydroxymethyl indol-3-yl ketone is found in mushrooms. Hydroxymethyl indol-3-yl ketone is an alkaloid from liquid cultures of the fungus Lactarius deliciosus.
Alkaloid from liquid cultures of the fungus Lactarius deliciosus. Hydroxymethyl indol-3-yl ketone is found in mushrooms.

同义名列表

10 个代谢物同义名

2-Hydroxy-1-(1H-indol-3-yl)ethanone, 9ci; 2-hydroxy-1-(1H-indol-3-yl)ethan-1-one; Hydroxymethyl indol-3-yl ketone, 8ci; 2-Hydroxy-1-(1H-indol-3-yl)-ethanone; 2-Hydroxy-1-(1H-indol-3-yl)ethanone; Hydroxymethyl indol-3-yl ketone; 3-(Hydroxylacetyl)-indole; 3-(Hydroxyacetyl)indole; 3-Glyceroindole; INDOLE-3-ketol

数据库引用编号

11 个数据库交叉引用编号

ChEBI: CHEBI:173472
PubChem: 200631
HMDB: HMDB0038628
ChEMBL: CHEMBL524903
MetaCyc: INDOLE-3-KETOL
foodb: FDB018022
chemspider: 173681
CAS: 2400-51-3
PMhub: MS000210730
LOTUS: LTS0084198
wikidata: Q75067236

分类词条

Indoles

代谢反应

1 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(1)

L-tryptophan degradation V (side chain pathway): NAD(P)⁺ + indole-3-ethanol ⟶ (indol-3-yl)acetaldehyde + H⁺ + NAD(P)H

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

7 个相关的物种来源信息

9606 - Homo sapiens: -
55514 - Lactarius deliciosus: 10.1021/NP50108A026
55194 - Malassezia furfur: 10.1002/HLCA.200590118
31457 - Prionitis lanceolata: 10.1016/0031-9422(90)85315-7
1883 - Streptomyces:
278976 - Tedania ignis: 10.1021/NP50076A021
148960 - Wallemia sebi: 10.1007/S12272-011-0607-0

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

Janggyoo Choi, Kee Dong Yoon, Jinwoong Kim. Chemical constituents from Taraxacum officinale and their α-glucosidase inhibitory activities. Bioorganic & medicinal chemistry letters. 2018 02; 28(3):476-481. doi: 10.1016/j.bmcl.2017.12.014. [PMID: 29254644]
Nishikant Wase, Boqiang Tu, James W Allen, Paul N Black, Concetta C DiRusso. Identification and Metabolite Profiling of Chemical Activators of Lipid Accumulation in Green Algae. Plant physiology. 2017 Aug; 174(4):2146-2165. doi: 10.1104/pp.17.00433. [PMID: 28652262]