Citronellic acid (BioDeep_00000858473)

Volatile Flavor Compounds natural product

代谢物信息卡片

Citronellic acid

化学式: C10H18O2 (170.1306728)
中文名称: 香茅酸, 3,7-二甲基-6-辛酸
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC(=CCCC(C)CC(=O)O)C
InChI: InChI=1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12)

描述信息

同义名列表

3 个代谢物同义名

Citronellic acid; Citronellate; 6-Octenoic acid, 3,7-dimethyl-

数据库引用编号

11 个数据库交叉引用编号

ChEBI: CHEBI:80507
KEGGdrug: D89451
PubChem: 10402
ChEMBL: CHEMBL2288023
CAS: 57030-77-0
CAS: 502-47-6
RefMet: Citronellic acid
KEGG: C16462
PubChem: 47205758
KNApSAcK: 80507
LOTUS: LTS0124944

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)

67 个相关的物种来源信息

13414 - Chamaecyparis: LTS0124944
13415 - Chamaecyparis obtusa: 10.1002/CHIN.200303162
13415 - Chamaecyparis obtusa: LTS0124944
87658 - Corymbia: LTS0124944
34329 - Corymbia citriodora: 10.1080/10412905.1991.9697921
34329 - Corymbia citriodora: 10.1080/10412905.1992.9698059
34329 - Corymbia citriodora: LTS0124944
87660 - Corymbia maculata: 10.1080/10412905.1991.9697921
87660 - Corymbia maculata: LTS0124944
3367 - Cupressaceae: LTS0124944
66679 - Daphne: LTS0124944
329675 - Daphne odora: 10.1271/BBB1961.47.483
329675 - Daphne odora: LTS0124944
2715869 - Daphne papyracea: 10.1271/BBB1961.47.483
2715869 - Daphne papyracea: LTS0124944
3932 - Eucalyptus: LTS0124944
183809 - Eucalyptus albens: 10.1080/10412905.1991.9697921
183809 - Eucalyptus albens: LTS0124944
1711162 - Eucalyptus astringens: 10.1080/10412905.1991.9697921
1711162 - Eucalyptus astringens: LTS0124944
338533 - Eucalyptus blakelyi: 10.1080/10412905.1991.9697921
338533 - Eucalyptus blakelyi: 10.1080/10412905.1992.9698059
338533 - Eucalyptus blakelyi: LTS0124944
1516054 - Eucalyptus bosistoana: 10.1080/10412905.1991.9697921
1516054 - Eucalyptus bosistoana: LTS0124944
33130 - Eucalyptus botryoides: 10.1080/10412905.1991.9697921
33130 - Eucalyptus botryoides: LTS0124944
34316 - Eucalyptus camaldulensis: 10.1080/10412905.1991.9697921
34316 - Eucalyptus camaldulensis: LTS0124944
452569 - Eucalyptus cladocalyx: 10.1080/10412905.1991.9697921
452569 - Eucalyptus cladocalyx: LTS0124944
1711250 - Eucalyptus dealbata: 10.1080/10412905.1991.9697921
1711250 - Eucalyptus dealbata: LTS0124944
166933 - Eucalyptus diversicolor: 10.1080/10412905.1991.9697921
166933 - Eucalyptus diversicolor: LTS0124944
2490922 - Eucalyptus exserta: LTS0124944
34317 - Eucalyptus globulus: 10.1080/10412905.1991.9697921
34317 - Eucalyptus globulus: LTS0124944
183838 - Eucalyptus melliodora: 10.1080/10412905.1991.9697921
183838 - Eucalyptus melliodora: LTS0124944
468242 - Eucalyptus moluccana: 10.1080/10412905.1991.9697921
468242 - Eucalyptus moluccana: LTS0124944
229548 - Eucalyptus occidentalis: 10.1080/10412905.1991.9697921
229548 - Eucalyptus occidentalis: LTS0124944
183847 - Eucalyptus polyanthemos: 10.1080/10412905.1991.9697921
183847 - Eucalyptus polyanthemos: LTS0124944
795993 - Eucalyptus siderophloia: 10.1080/10412905.1991.9697921
795993 - Eucalyptus siderophloia: LTS0124944
183855 - Eucalyptus tereticornis: 10.1080/10412905.1992.9698059
183855 - Eucalyptus tereticornis: LTS0124944
2759 - Eukaryota: LTS0124944
4027 - Geraniaceae: LTS0124944
3398 - Magnoliopsida: LTS0124944
3931 - Myrtaceae: LTS0124944
4030 - Pelargonium: LTS0124944
73200 - Pelargonium graveolens: 10.1021/JF60197A010
73200 - Pelargonium graveolens: LTS0124944
253086 - Pelargonium vitifolium: 10.1080/10412905.1992.9698083
253086 - Pelargonium vitifolium: LTS0124944
58019 - Pinopsida: LTS0124944
35493 - Streptophyta: LTS0124944
13726 - Thujopsis: LTS0124944
13727 - Thujopsis dolabrata: 10.1007/S12272-011-1218-5
13727 - Thujopsis dolabrata: LTS0124944
39987 - Thymelaeaceae: LTS0124944
58023 - Tracheophyta: LTS0124944
33090 - Viridiplantae: LTS0124944

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

Fan Tong, Joel R Coats. Quantitative structure-activity relationships of monoterpenoid binding activities to the housefly GABA receptor. Pest management science. 2012 Aug; 68(8):1122-9. doi: 10.1002/ps.3280. [PMID: 22461383]
Alicia K Phillips, Arthur G Appel. Fumigant toxicity of essential oils to the German cockroach (Dictyoptera: Blattellidae). Journal of economic entomology. 2010 Jun; 103(3):781-90. doi: 10.1603/ec09358. [PMID: 20568624]
Alicia K Phillips, Arthur G Appel, Steven R Sims. Topical toxicity of essential oils to the German cockroach (Dictyoptera: Blattellidae). Journal of economic entomology. 2010 Apr; 103(2):448-59. doi: 10.1603/ec09192. [PMID: 20429462]
S S Essam Abdel, Canyon Deon Vahid, Bowden Bruce, F Y Mohamed Wagdy, W Abdel Hoda Abdel, M Abdel Hamid. Efficacy of botanical extracts from Callitris glaucophylla, against Aedes aegypti and Culex annulirostris mosquitoes. Tropical biomedicine. 2006 Dec; 23(2):180-5. doi: ". [PMID: 17322820]
J Modestin, A Petrin. [Correlation between plasma concentration and clinical effect of neuroleptics and antidepressants]. International journal of clinical pharmacology and biopharmacy. 1976 Jan; 13(1):11-21. doi: NULL. [PMID: 2561]