S-Methyl methanesulfinothioate (BioDeep_00000025444)

Secondary id: BioDeep_00000617884, BioDeep_00001871878

human metabolite

代谢物信息卡片

Methanesulfinic acid, thio-, S-methyl ester (6ci,7ci,8ci)

化学式: C2H6OS2 (109.9860066)
中文名称:
谱图信息: 最多检出来源 Homo sapiens(natural_products) 13.17%

分子结构信息

SMILES: CSS(=O)C
InChI: InChI=1S/C2H6OS2/c1-4-5(2)3/h1-2H3

描述信息

S-Methyl methanesulfinothioate is found in garden onion. S-Methyl methanesulfinothioate is a constituent of Allium species.
Constituent of Allium subspecies S-Methyl methanesulfinothioate is found in garden onion and onion-family vegetables.

同义名列表

22 个代谢物同义名

Methanesulfinic acid, thio-, S-methyl ester (6ci,7ci,8ci); Methanesulfinothioic acid, S-methyl ester; Methyl methanethiosulfinate, (+-)-isomer; Methyl methanethiosulfinate, (S)-isomer; Methyl methanethiosulfinate, (R)-isomer; S-Methyl methanesulphinothioic acid; S-Methylmethane thiosulphinic acid; (Methanesulphinylsulphanyl)methane; S-Methyl methanesulfinothioic acid; S-Methylmethane thiosulfinic acid; (methanesulfinylsulfanyl)methane; S-Methyl methanesulphinothioate; S-Methyl methanesulfinothioate; S-Methylmethane thiosulphinate; S-Methyl methanethiosulfinate; Methyl methane thiosulphinate; S-Methyl thiomethanesulfinate; S-Methylmethane thiosulfinate; Methyl methane thiosulfinate; Methyl methanethiosulfinate; Dimethyldisulfide, S-oxide; Dimethyl thiosulfinate

数据库引用编号

9 个数据库交叉引用编号

ChEBI: CHEBI:184354
PubChem: 95200
HMDB: HMDB0032739
ChEMBL: CHEMBL403038
MetaCyc: CPD-17445
foodb: FDB010701
chemspider: 85904
CAS: 13882-12-7
PMhub: MS000187338

分类词条

代谢反应

1 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(1)

methiin metabolism: methanesulfenate ⟶ H₂O + dimethyl thiosulfinate

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

19 个相关的物种来源信息

4682 Allium sativum:
4684 Allium ursinum:
166816 Allium obliquum: 10.1021/NP0503350
74900 Allium schoenoprasum: 10.1021/NP0503350
4681 Allium ampeloprasum: 10.1021/NP0503350
4679 Allium cepa:
1476995 Allium ascalonicum: 10.1021/NP0503350
35875 Allium fistulosum: 10.1021/NP0503350
4683 Allium tuberosum:
4682 Allium sativum:
4684 Allium ursinum:
166816 Allium obliquum: 10.1021/NP0503350
74900 Allium schoenoprasum: 10.1021/NP0503350
4681 Allium ampeloprasum: 10.1021/NP0503350
4679 Allium cepa:
1476995 Allium ascalonicum: 10.1021/NP0503350
35875 Allium fistulosum: 10.1021/NP0503350
4683 Allium tuberosum:
9606 Homo sapiens: -

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

Yuko Watanabe, Ryoko Muroi, Haruna Tsuchiya, Yasushi Uda, Kei Hashimoto. Inhibitory effect of methyl methanethiosulfinate on β-glucuronidase activity. Bioscience, biotechnology, and biochemistry. 2013; 77(11):2325-7. doi: 10.1271/bbb.130510. [PMID: 24200790]
So-Yeon Kim, Kyoung-Wuk Park, Jae-Yong Kim, Il-Yun Jeong, Myung-Woo Byun, Jung-Eun Park, Sung-Tae Yee, Kee-Hong Kim, Johng S Rhim, Koji Yamada, Kwon-Il Seo. Thiosulfinates from Allium tuberosum L. induce apoptosis via caspase-dependent and -independent pathways in PC-3 human prostate cancer cells. Bioorganic & medicinal chemistry letters. 2008 Jan; 18(1):199-204. doi: 10.1016/j.bmcl.2007.10.099. [PMID: 18024112]