Citropten (BioDeep_00000017234)

 

Secondary id: BioDeep_00000411047, BioDeep_00000413127, BioDeep_00000863362

human metabolite PANOMIX_OTCML-2023


代谢物信息卡片


InChI=1/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3

化学式: C11H10O4 (206.057906)
中文名称: 5,7-二甲氧基香豆素, 白柠檬素, 柠美内酯
谱图信息: 最多检出来源 Viridiplantae(plant) 28.09%

分子结构信息

SMILES: COC1=CC(OC)=C2C=CC(=O)OC2=C1
InChI: InChI=1S/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3

描述信息

5,7-dimethoxy-1-benzopyran-2-one is a member of coumarins.
5,7-Dimethoxycoumarin is a natural product found in Edgeworthia chrysantha, Melicope borbonica, and other organisms with data available.
Citropten is found in citrus. Citropten is found in lime and bergamot oils.
Found in lime and bergamot oils
Citropten (5,7-Dimethoxycoumarin) is a coumarin isolated from bergamot oil. Citropten (5,7-Dimethoxycoumarin) has an antiproliferative activity against A2058 human melanoma cell line[1][2].
Citropten (5,7-Dimethoxycoumarin) is a coumarin isolated from bergamot oil. Citropten (5,7-Dimethoxycoumarin) has an antiproliferative activity against A2058 human melanoma cell line[1][2].

同义名列表

50 个代谢物同义名

InChI=1/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3; 5-18-03-00199 (Beilstein Handbook Reference); doi:10.14272/NXJCRELRQHZBQA-UHFFFAOYSA-N.1; 10.14272/NXJCRELRQHZBQA-UHFFFAOYSA-N.1; 5,7-Dimethyloxy-2H-1-benzopyran-2-one; 2H-1-Benzopyran-2-one, 5,7-dimethoxy-; 5,7-dimethoxychromen-2-one;Citropten; 5,7-Dimethoxy-2H-1-benzo-pyran-2-one; 5,7-Dimethoxy-2H-1-benzopyran-2-one; 2H-1-Benzopyran-2-one,7-dimethoxy-; 5,7-Dimethoxycoumarin;Limettin; Citropten, analytical standard; 5,7-Dimethoxy-2H-chromen-2-one; 5,7-Dimethoxycoumarin, 98\\%; 5,7-Dimethoxy-chromen-2-one; NXJCRELRQHZBQA-UHFFFAOYSA-N; 5,7-Dimethoxy-2-benzopyrone; 5,7-dimethoxychromen-2-one; NXJCRELRQHZBQA-UHFFFAOYSA-; COUMARIN, 5,7-DIMETHOXY-; Coumarin derivative, 2a; DIMETHOXYCOUMARIN, 5,7-; 5, 7-Dimethoxycoumarin; 5,7-dimethoxy-coumarin; 5,7-Dimethoxycoumarin; Coumarin,7-dimethoxy-; 57-Dimethoxycoumarin; Spectrum3_001398; Spectrum2_000814; Spectrum4_000781; Spectrum5_001348; UNII-JWE1QQ247N; LIMETTIN [MI]; omphamurrayin; DivK1c_000391; KBio1_000391; KBio2_000723; KBio2_003291; KBio3_002236; Tox21_300942; KBio2_005859; IDI1_000391; Citroptene; JWE1QQ247N; Citraptene; 1ST164126; Citropten; AI3-36094; limettin; Limetin



数据库引用编号

13 个数据库交叉引用编号

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)

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

  • Yu Zhen Tang, Ying Liu, Ya Ping Chen, Ting Ting Feng, Ya Yi Liu, Yan Wang, Jun Ping Zhang, Wei Heng Xu. Citropten alleviates acute and recurrent colitis via blockage of NF-κB and JAK/STAT3 pathways. International immunopharmacology. 2023 Dec; 125(Pt A):111102. doi: 10.1016/j.intimp.2023.111102. [PMID: 37922567]
  • Haipeng Zhang, Huan Wen, Jiajing Chen, Zhaoxin Peng, Meiyan Shi, Mengjun Chen, Ziyu Yuan, Yuan Liu, Hongyan Zhang, Juan Xu. Volatile Compounds in Fruit Peels as Novel Biomarkers for the Identification of Four Citrus Species. Molecules (Basel, Switzerland). 2019 Dec; 24(24):. doi: 10.3390/molecules24244550. [PMID: 31842378]
  • Tobie D Lee, Olivia W Lee, Kyle R Brimacombe, Lu Chen, Rajarshi Guha, Sabrina Lusvarghi, Bethilehem G Tebase, Carleen Klumpp-Thomas, Robert W Robey, Suresh V Ambudkar, Min Shen, Michael M Gottesman, Matthew D Hall. A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular pharmacology. 2019 11; 96(5):629-640. doi: 10.1124/mol.119.115964. [PMID: 31515284]
  • Angelo Gismondi, Valentina Nanni, Giacomo Reina, Silvia Orlanducci, Maria Letizia Terranova, Antonella Canini. Nanodiamonds coupled with 5,7-dimethoxycoumarin, a plant bioactive metabolite, interfere with the mitotic process in B16F10 cells altering the actin organization. International journal of nanomedicine. 2016; 11(?):557-74. doi: 10.2147/ijn.s96614. [PMID: 26893562]
  • Nicole Raquet, Dieter Schrenk. Application of the equivalency factor concept to the phototoxicity and -genotoxicity of furocoumarin mixtures. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association. 2014 Jun; 68(?):257-66. doi: 10.1016/j.fct.2014.03.014. [PMID: 24680798]
  • Henrique D de Menezes, Ana C Pereira, Guilherme T P Brancini, Helton Carlos de Leão, Nelson S Massola Júnior, Luciano Bachmann, Mark Wainwright, Jairo Kenupp Bastos, Gilberto U L Braga. Furocoumarins and coumarins photoinactivate Colletotrichum acutatum and Aspergillus nidulans fungi under solar radiation. Journal of photochemistry and photobiology. B, Biology. 2014 Feb; 131(?):74-83. doi: 10.1016/j.jphotobiol.2014.01.008. [PMID: 24509069]
  • 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]
  • Pius S Fasinu, Patrick J Bouic, Bernd Rosenkranz. An overview of the evidence and mechanisms of herb-drug interactions. Frontiers in pharmacology. 2012; 3(?):69. doi: 10.3389/fphar.2012.00069. [PMID: 22557968]
  • Joabe Gomes de Melo, Ariane Gaspar Santos, Elba Lúcia Cavalcanti de Amorim, Silene Carneiro do Nascimento, Ulysses Paulino de Albuquerque. Medicinal plants used as antitumor agents in Brazil: an ethnobotanical approach. Evidence-based complementary and alternative medicine : eCAM. 2011; 2011(?):365359. doi: 10.1155/2011/365359. [PMID: 21528006]
  • Tao Feng, Rui-Rui Wang, Xiang-Hai Cai, Yong-Tang Zheng, Xiao-Dong Luo. Anti-human immunodeficiency virus-1 constituents of the bark of Poncirus trifoliata. Chemical & pharmaceutical bulletin. 2010 Jul; 58(7):971-5. doi: 10.1248/cpb.58.971. [PMID: 20606349]
  • E Gorgus, C Lohr, N Raquet, S Guth, D Schrenk. Limettin and furocoumarins in beverages containing citrus juices or extracts. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association. 2010 Jan; 48(1):93-8. doi: 10.1016/j.fct.2009.09.021. [PMID: 19770019]
  • Nicole Raquet, Dieter Schrenk. Relative photomutagenicity of furocoumarins and limettin in the hypoxanthine phosphoribosyl transferase assay in V79 cells. Chemical research in toxicology. 2009 Sep; 22(9):1639-47. doi: 10.1021/tx9002287. [PMID: 19725558]
  • Jinglan Han, Fengling Zhang, Zhihong Li, Guanhua Du, Hailin Qin. [Chemical constituents of Lobelia chinensis]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2009 Sep; 34(17):2200-2. doi: . [PMID: 19943485]
  • Raffaella Perazzini, Donatella Leonardi, Stefania Ruggeri, Daniela Alesiani, Giuseppe D'Arcangelo, Antonella Canini. Characterization of Phaseolus vulgaris L. landraces cultivated in central Italy. Plant foods for human nutrition (Dordrecht, Netherlands). 2008 Dec; 63(4):211-8. doi: 10.1007/s11130-008-0095-7. [PMID: 18958625]
  • Henrik Toft Simonsen, Anne Adsersen, Paul Bremner, Michael Heinrich, Ulla Wagner Smitt, Jerzy W Jaroszewski. Antifungal constituents of Melicope borbonica. Phytotherapy research : PTR. 2004 Jul; 18(7):542-5. doi: 10.1002/ptr.1482. [PMID: 15305313]
  • A Salvatore, S Borkosky, E Willink, A Bardón. Toxic effects of lemon peel constituents on Ceratitis capitata. Journal of chemical ecology. 2004 Feb; 30(2):323-33. doi: 10.1023/b:joec.0000017980.66124.d1. [PMID: 15112727]
  • Ya-Tze Lin, Su-Lan Hsiu, Yu-Chi Hou, Hung-Yi Chen, Pei-Dawn Lee Chao. Degradation of flavonoid aglycones by rabbit, rat and human fecal flora. Biological & pharmaceutical bulletin. 2003 May; 26(5):747-51. doi: 10.1248/bpb.26.747. [PMID: 12736527]
  • Takeshi Kinoshita, Motoko Shimada. Isolation and structure elucidation of a new prenylcoumarin from Murraya paniculata var. omphalocarpa (Rutaceae). Chemical & pharmaceutical bulletin. 2002 Jan; 50(1):118-20. doi: 10.1248/cpb.50.118. [PMID: 11824571]
  • D Chouchi, D Barth. Rapid identification of some coumarin derivatives in deterpenated citrus peel oil by gas chromatography. Journal of chromatography. A. 1994 Jun; 672(1-2):177-83. doi: 10.1016/0021-9673(94)80606-3. [PMID: 8069393]
  • Y Yoke Marchant, M Turjman, T Flynn, F Balza, J C Mitchell, G H Towers. Identification of psoralen, 8-methoxypsoralen, isopimpinellin, and 5,7-dimethoxycoumarin in Pelea anisata H. Mann. Contact dermatitis. 1985 Apr; 12(4):196-9. doi: 10.1111/j.1600-0536.1985.tb01105.x. [PMID: 4017567]