Gentisin (BioDeep_00000229847)

Secondary id: BioDeep_00000007854, BioDeep_00000862046

human metabolite PANOMIX_OTCML-2023 Endogenous

代谢物信息卡片

1,7-Dihydroxy-3-methoxyxanthone; 1,7-Dihydroxy-3-methoxyxanthen-9-one

化学式: C14H10O5 (258.052821)
中文名称: 龙胆根素, 龍膽根素
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 3.23%

分子结构信息

SMILES: c1(cc(c2c(c1)oc1c(c2=O)cc(cc1)O)O)OC
InChI: InChI=1S/C14H10O5/c1-18-8-5-10(16)13-12(6-8)19-11-3-2-7(15)4-9(11)14(13)17/h2-6,15-16H,1H3

描述信息

Gentisin is a member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1 and 7 and a methoxy group at position 3. It has a role as a plant metabolite. It is a member of xanthones, a polyphenol and an aromatic ether.
Gentisin is a natural product found in Pterocarpus santalinus, Gentiana orbicularis, and other organisms with data available.
See also: Menyanthes trifoliata leaf (part of).
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1 and 7 and a methoxy group at position 3.
Gentisin is found in alcoholic beverages. Gentisin is a pigment from root of Gentiana lutea (yellow gentian

同义名列表

20 个代谢物同义名

1,7-Dihydroxy-3-methoxyxanthone; 1,7-Dihydroxy-3-methoxyxanthen-9-one; 9H-Xanthen-9-one, 1,7-dihydroxy-3-methoxy-; 9H-Xanthen-9-one,1,7-dihydroxy-3-methoxy-; 1,7-dihydroxy-3-methoxy-9H-xanthen-9-one; Xanthen-9-one, 1,7-dihydroxy-3-methoxy-; 1,7-dihydroxy-3-methoxy-xanthen-9-one; 1,7-Dihydroxy-3-methoxyxanthen-9-one; 4,7-Dihydroxy-2-methoxyxanthone; 1,7-Dihydroxy-3-methoxyxanthone; 1,7-dihydroxy-3-methoxyanthone; UNII-K57MOP2HM0; GENTIANIC ACID; GENTISIN [MI]; K57MOP2HM0; Gentianin?; Gentianin; Gentisine; Gentisin; A1-01883; Gentiin

数据库引用编号

17 个数据库交叉引用编号

ChEBI: CHEBI:5324
KEGG: C10066
PubChem: 5281636
HMDB: HMDB0031760
ChEMBL: CHEMBL3093478
MeSH: gentisin
ChemIDplus: 0000437503
KNApSAcK: C00002954
foodb: FDB008432
chemspider: 4444955
CAS: 437-50-3
medchemexpress: HY-N4279
MetaboLights: MTBLC5324
PubChem: 12252
3DMET: B03508
NIKKAJI: J5.737A
RefMet: Gentisin

分类词条

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)

23 个相关的物种来源信息

7461 - Apis cerana: 10.1371/JOURNAL.PONE.0175573
280748 - Calophyllum brasiliense:
667334 - Calophyllum teysmannii:
38851 - Gentiana lutea:
1085736 - Gentiana orbicularis: 10.1016/0305-1978(82)90006-0
49940 - Gentianella campestris: 10.1016/0305-1978(82)90006-0
208027 - Gentianella serotina: 10.1016/0305-1978(82)90006-0
156522 - Gentianopsis barbata: 10.1016/0305-1978(82)90006-0
2884939 - Gentianopsis barbata var. stenocalyx: 10.1016/0305-1978(82)90006-0
49941 - Gentianopsis ciliata: 10.1016/0305-1978(82)90006-0
84894 - Gentianopsis crinita: 10.1016/0305-1978(82)90006-0
669700 - Gentianopsis detonsa: 10.1016/0305-1978(82)90006-0
50801 - Gentianopsis grandis: 10.1016/0305-1978(82)90006-0
866904 - Gentianopsis lanceolata: 10.1016/0305-1978(82)90006-0
50802 - Gentianopsis paludosa: 10.1016/0305-1978(82)90006-0
866906 - Gentianopsis thermalis: 10.1016/0305-1978(82)90006-0
2065894 - Gentianopsis virgata: 10.1016/0305-1978(82)90006-0
9606 - Homo sapiens: -
355332 - Polygala tenuifolia:
1071199 - Pterocarpus santalinus: 10.1039/JR9530003693
346985 - Senna obtusifolia: 10.1016/J.TET.2008.05.125
137129 - Swertia japonica: 10.1248/YAKUSHI1881.1927.540_144
39380 - Swertia petiolata:

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

Chaohong Yin, Longwei Xie, Yun Guo. Phytochemical analysis and antibacterial activity of Gentiana macrophylla extract against bacteria isolated from burn wound infections. Microbial pathogenesis. 2018 Jan; 114(?):25-28. doi: 10.1016/j.micpath.2017.10.049. [PMID: 29111322]
Qiwen Wang, Chenyao Ma, Yun Ma, Xiang Li, Yong Chen, Jianwei Chen. Structure-activity relationships of diverse xanthones against multidrug resistant human tumor cells. Bioorganic & medicinal chemistry letters. 2017 02; 27(3):447-449. doi: 10.1016/j.bmcl.2016.12.045. [PMID: 28065566]
Dya Fita Dibwe, Suresh Awale, Shigetoshi Kadota, Hiroyuki Morita, Yasuhiro Tezuka. Heptaoxygenated xanthones as anti-austerity agents from Securidaca longepedunculata. Bioorganic & medicinal chemistry. 2013 Dec; 21(24):7663-8. doi: 10.1016/j.bmc.2013.10.027. [PMID: 24216090]
Namki Cho, Jungmoo Huh, Heejung Yang, Eun Ju Jeong, Young Choong Kim, Jinwoong Kim, Sang Hyun Sung. Chemical constituents of Polygala tenuifolia roots and their inhibitory activity on lipopolysaccharide-induced nitric oxide production in BV2 microglia. Journal of enzyme inhibition and medicinal chemistry. 2012 Feb; 27(1):1-4. doi: 10.3109/14756366.2011.562203. [PMID: 21740104]
Ngoc Trang Nhu Ngo, Vy Thuy Nguyen, Hoa Van Vo, Ole Vang, Fritz Duus, Thuy-Duong Huynh Ho, Hung Dinh Pham, Lien-Hoa Dieu Nguyen. Cytotoxic Coumarins from the Bark of Mammea siamensis. Chemical & pharmaceutical bulletin. 2010 Nov; 58(11):1487-91. doi: 10.1248/cpb.58.1487. [PMID: 21048341]
M Shekarchi, H Hajimehdipoor, M Khanavi, N Adib, M Bozorgi, B Akbari-Adergani. A validated method for analysis of Swerchirin in Swertia longifolia Boiss. by high performance liquid chromatography. Pharmacognosy magazine. 2010 Jan; 6(21):13-8. doi: 10.4103/0973-1296.59961. [PMID: 20548931]
Anita Aberham, Stefan Schwaiger, Hermann Stuppner, Markus Ganzera. Quantitative analysis of iridoids, secoiridoids, xanthones and xanthone glycosides in Gentiana lutea L. roots by RP-HPLC and LC-MS. Journal of pharmaceutical and biomedical analysis. 2007 Nov; 45(3):437-42. doi: 10.1016/j.jpba.2007.07.001. [PMID: 17697760]
Jih-Jung Chen, Chien-Fang Peng, Hung-Yi Huang, Ih-Sheng Chen. Benzopyrans, biphenyls and xanthones from the root of Garcinia linii and their activity against Mycobacterium tuberculosis. Planta medica. 2006 Apr; 72(5):473-7. doi: 10.1055/s-2005-916253. [PMID: 16557464]
I Morimoto, T Nozaka, F Watanabe, M Ishino, Y Hirose, T Okitsu. Mutagenic activities of gentisin and isogentisin from Gentianae radix (Gentianaceae). Mutation research. 1983 Feb; 116(2):103-17. doi: 10.1016/0165-1218(83)90101-5. [PMID: 6338357]