β-Naphthoflavone (BioDeep_00000412768)
Main id: BioDeep_00000176640
natural product
代谢物信息卡片
化学式: C19H12O2 (272.0837252)
中文名称: β-萘黄酮
谱图信息:
最多检出来源 Helianthus annuus(natural_products) 50%
分子结构信息
SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43
InChI: InChI=1S/C19H12O2/c20-16-12-18(14-7-2-1-3-8-14)21-17-11-10-13-6-4-5-9-15(13)19(16)17/h1-12H
描述信息
C1892 - Chemopreventive Agent > C54629 - Phase I Enzymes Inhibitor
C1892 - Chemopreventive Agent > C54630 - Phase II Enzymes Inducer
D004791 - Enzyme Inhibitors > D001571 - Benzoflavones
CONFIDENCE standard compound; INTERNAL_ID 1179; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10249; ORIGINAL_PRECURSOR_SCAN_NO 10247
CONFIDENCE standard compound; INTERNAL_ID 1179; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10266; ORIGINAL_PRECURSOR_SCAN_NO 10265
CONFIDENCE standard compound; INTERNAL_ID 1179; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10292; ORIGINAL_PRECURSOR_SCAN_NO 10291
CONFIDENCE standard compound; INTERNAL_ID 1179; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10225; ORIGINAL_PRECURSOR_SCAN_NO 10224
CONFIDENCE standard compound; INTERNAL_ID 1179; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10335; ORIGINAL_PRECURSOR_SCAN_NO 10334
CONFIDENCE standard compound; INTERNAL_ID 1179; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10310; ORIGINAL_PRECURSOR_SCAN_NO 10308
同义名列表
3 个代谢物同义名
数据库引用编号
14 个数据库交叉引用编号
- ChEBI: CHEBI:77013
- PubChem: 2361
- DrugBank: DB06732
- ChEMBL: CHEMBL26260
- MeSH: beta-Naphthoflavone
- CAS: 6051-87-2
- MoNA: LU117906
- MoNA: LU117905
- MoNA: LU117904
- MoNA: LU117903
- MoNA: LU117902
- MoNA: LU117901
- MoNA: CCMSLIB00005724325
- RefMet: 5,6-Benzoflavone
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)
0 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
- Carolin Riegraf, Georg Reifferscheid, Liat Moscovici, Dror Shakibai, Henner Hollert, Shimshon Belkin, Sebastian Buchinger. Coupling high-performance thin-layer chromatography with a battery of cell-based assays reveals bioactive components in wastewater and landfill leachates.
Ecotoxicology and environmental safety.
2021 May; 214(?):112092. doi:
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Biological chemistry.
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Molecular biology reports.
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Aquatic toxicology (Amsterdam, Netherlands).
2008 Feb; 86(3):341-51. doi:
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Environmental toxicology.
2008 Feb; 23(1):68-76. doi:
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Ecotoxicology and environmental safety.
2008 Feb; 69(2):180-6. doi:
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Toxicological sciences : an official journal of the Society of Toxicology.
2008 Jan; 101(1):51-64. doi:
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Marine pollution bulletin.
2008; 57(6-12):433-40. doi:
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Planta.
2007 Dec; 227(1):37-45. doi:
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Molecular pharmacology.
2007 Dec; 72(6):1419-24. doi:
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Toxicology.
2007 Oct; 240(1-2):25-37. doi:
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Regulatory toxicology and pharmacology : RTP.
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The Journal of pharmacology and experimental therapeutics.
2007 Jul; 322(1):40-7. doi:
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Toxicology and applied pharmacology.
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Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals.
2007 May; 12(3):240-55. doi:
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Drug metabolism and disposition: the biological fate of chemicals.
2007 Apr; 35(4):633-9. doi:
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Environmental science & technology.
2007 Jan; 41(2):652-7. doi:
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Neuro endocrinology letters.
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Chemosphere.
2006 Dec; 65(10):1821-30. doi:
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Drug metabolism and disposition: the biological fate of chemicals.
2006 Oct; 34(10):1742-8. doi:
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Mutation research.
2006 Sep; 608(1):16-28. doi:
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Aquatic toxicology (Amsterdam, Netherlands).
2006 Aug; 79(1):78-86. doi:
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Environmental health perspectives.
2006 Aug; 114(8):1297-300. doi:
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International journal of clinical pharmacology and therapeutics.
2006 May; 44(5):225-32. doi:
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Endocrinology.
2006 Apr; 147(4):1895-903. doi:
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BMC cancer.
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Aquatic toxicology (Amsterdam, Netherlands).
2006 Mar; 76(3-4):295-305. doi:
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Journal of natural products.
2006 Mar; 69(3):421-4. doi:
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Cell and tissue research.
2006 Mar; 323(3):433-42. doi:
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Carcinogenesis.
2005 Nov; 26(11):2019-28. doi:
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Chemosphere.
2005 Oct; 61(2):267-75. doi:
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Toxicological sciences : an official journal of the Society of Toxicology.
2005 Apr; 84(2):260-9. doi:
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Journal of applied toxicology : JAT.
2005 Mar; 25(2):153-65. doi:
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Analytical biochemistry.
2005 Feb; 337(1):84-8. doi:
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Toxicology in vitro : an international journal published in association with BIBRA.
2005 Feb; 19(1):21-30. doi:
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Environmental toxicology.
2005 Feb; 20(1):92-9. doi:
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Biomedical chromatography : BMC.
2005 Jan; 19(1):87-98. doi:
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In vitro cellular & developmental biology. Animal.
2005 Jan; 41(1-2):57-63. doi:
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The Journal of clinical endocrinology and metabolism.
2005 Jan; 90(1):247-55. doi:
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Drug metabolism and disposition: the biological fate of chemicals.
2005 Jan; 33(1):19-22. doi:
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Environment international.
2005 Jan; 31(1):99-104. doi:
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Environmental sciences : an international journal of environmental physiology and toxicology.
2005; 12(2):111-20. doi:
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Free radical research.
2004 Nov; 38(11):1191-200. doi:
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The Journal of pharmacology and experimental therapeutics.
2004 Oct; 311(1):147-54. doi:
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Chemosphere.
2004 Oct; 57(2):147-58. doi:
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Chemical research in toxicology.
2004 Aug; 17(8):1092-101. doi:
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Drug metabolism and disposition: the biological fate of chemicals.
2004 Jul; 32(7):758-61. doi:
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