Lapachenole (BioDeep_00000007703)
Secondary id: BioDeep_00001869564
human metabolite natural product
代谢物信息卡片
化学式: C16H16O2 (240.1150236)
中文名称:
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CC1(C=CC2=C(O1)C3=CC=CC=C3C(=C2)OC)C
InChI: InChI=1S/C16H16O2/c1-16(2)9-8-11-10-14(17-3)12-6-4-5-7-13(12)15(11)18-16/h4-10H,1-3H3
描述信息
Lapachenole is a member of the class of compounds known as naphthopyrans. Naphthopyrans are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. Lapachenole is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Lapachenole can be found in mexican oregano, which makes lapachenole a potential biomarker for the consumption of this food product.
同义名列表
数据库引用编号
16 个数据库交叉引用编号
- ChEBI: CHEBI:6376
- KEGG: C09950
- PubChem: 174859
- HMDB: HMDB0301851
- Metlin: METLIN68037
- ChEMBL: CHEMBL461774
- KNApSAcK: C00003002
- foodb: FDB001519
- chemspider: 152480
- CAS: 573-13-7
- PMhub: MS000021163
- PubChem: 12136
- 3DMET: B03405
- NIKKAJI: J11.530D
- KNApSAcK: 6376
- LOTUS: LTS0095814
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)
24 个相关的物种来源信息
- 24079 - Bignoniaceae: LTS0095814
- 2759 - Eukaryota: LTS0095814
- 1288022 - Handroanthus: LTS0095814
- 429701 - Handroanthus impetiginosus:
- 9606 - Homo sapiens: -
- 320344 - Lippia: LTS0095814
- 1986359 - Lippia graveolens: 10.1055/S-2006-961937
- 1986359 - Lippia graveolens: LTS0095814
- 542673 - Lippia origanoides:
- 542673 - Lippia origanoides: 10.1021/NP0005917
- 542673 - Lippia origanoides: 10.1021/NP50044A019
- 542673 - Lippia origanoides: 10.1055/S-2006-961937
- 542673 - Lippia origanoides: 10.4268/CJCMM20162420
- 542673 - Lippia origanoides: LTS0095814
- 320357 - Lippia sidoides:
- 320357 - Lippia sidoides: 10.1021/NP0005917
- 320357 - Lippia sidoides: 10.1021/NP50044A019
- 320357 - Lippia sidoides: 10.4268/CJCMM20162420
- 3398 - Magnoliopsida: LTS0095814
- 1531355 - Rubia alata:
- 35493 - Streptophyta: LTS0095814
- 58023 - Tracheophyta: LTS0095814
- 21910 - Verbenaceae: LTS0095814
- 33090 - Viridiplantae: LTS0095814
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
- Dilamara R Scharf, Maria H Verdan, Marcos A Ribeiro, Edesio L Simionatto, Eduardo L Sá, Marcos J Salvador, Andersson Barison, Maria E A Stefanello. Naphthochromenes and Related Constituents from the Tubers of Sinningia allagophylla.
Journal of natural products.
2016 Apr; 79(4):792-8. doi:
10.1021/acs.jnatprod.5b00799. [PMID: 27043314]