3-Methyl-1,2-cyclopentanedione (BioDeep_00000024378)
human metabolite Endogenous
代谢物信息卡片
化学式: C6H8O2 (112.05242679999999)
中文名称: 3-甲基-1,2-环戊二酮, 3-甲基环戊烷-1,2-二酮
谱图信息:
最多检出来源 Mus musculus(not specific) 5.87%
分子结构信息
SMILES: CC1CCC(=O)C1=O
InChI: InChI=1S/C6H8O2/c1-4-2-3-5(7)6(4)8/h4H,2-3H2,1H3
描述信息
3-Methyl-1,2-cyclopentanedione is found in cereals and cereal products. 3-Methyl-1,2-cyclopentanedione is a constituent of coffee aroma, roast barley and many other foods. 3-Methyl-1,2-cyclopentanedione is an important flavouring ingredient
Constituent of coffee aroma, roast barley and many other foods. Important flavouring ingredient. 3-Methyl-1,2-cyclopentanedione is found in cereals and cereal products and coffee and coffee products.
同义名列表
数据库引用编号
9 个数据库交叉引用编号
- ChEBI: CHEBI:173373
- PubChem: 16211403
- PubChem: 61209
- HMDB: HMDB0031543
- ChEMBL: CHEMBL371371
- foodb: FDB008153
- chemspider: 55153
- CAS: 765-70-8
- PMhub: MS000144008
分类词条
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
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)
1 个相关的物种来源信息
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
- Nallely E Sandoval-Montemayor, Abraham García, Elizabeth Elizondo-Treviño, Elvira Garza-González, Laura Alvarez, María del Rayo Camacho-Corona. Chemical composition of hexane extract of Citrus aurantifolia and anti-Mycobacterium tuberculosis activity of some of its constituents.
Molecules (Basel, Switzerland).
2012 Sep; 17(9):11173-84. doi:
10.3390/molecules170911173
. [PMID: 22992784] - Hyung Jin Kim, In-Seob Bae, Sang-Jin Cho, Jin-Hyo Boo, Byung-Cheo Lee, Jinhee Heo, Ilsub Chung, Byungyou Hong. Synthesis and characteristics of NH2-functionalized polymer films to align and immobilize DNA molecules.
Nanoscale research letters.
2012 Jan; 7(?):30. doi:
10.1186/1556-276x-7-30
. [PMID: 22221314] - YuHong Zhang, YuAn Feng, Chuan Wang. Improvement in the detection of impurities affecting ethylene glycol UV transmittance by gas chromatography-mass spectrometry.
Journal of chromatography. A.
2002 Dec; 982(2):255-60. doi:
10.1016/s0021-9673(02)01595-9
. [PMID: 12489881] - Ae Ra Kim, Yani Zou, Hyung Suk Kim, Jae Sue Choi, Gregory Youngnam Chang, You Jung Kim, Hae Young Chung. Selective peroxynitrite scavenging activity of 3-methyl-1,2-cyclopentanedione from coffee extract.
The Journal of pharmacy and pharmacology.
2002 Oct; 54(10):1385-92. doi:
10.1211/002235702760345473
. [PMID: 12396301] - K Murayama, N Shindo, H Koide. A modification of determination for glucosamine and galactosamine in glycoprotein with the amino acid analyzer. Application to total acid hydrolyzate of rat renal glomerular basement membrane.
Analytical biochemistry.
1976 Feb; 70(2):537-41. doi:
10.1016/0003-2697(76)90479-6
. [PMID: 4992]