(±)-Menthyl acetate (BioDeep_00000007650)
Secondary id: BioDeep_00000228667, BioDeep_00000264676, BioDeep_00000396906, BioDeep_00000872988, BioDeep_00001868479
human metabolite PANOMIX_OTCML-2023 Endogenous
代谢物信息卡片
化学式: C12H22O2 (198.1619712)
中文名称: [1R-(1α,2β,5α)]-乙酸-5-甲基-2-(1-甲基乙基)环己酯, 乙酸-L-孟酯, 乙酸薄荷酯, 三萜醇乙酸酯, 环己醇,5-甲基-2-(1-甲基乙基)-,1-乙酸酯,(1R,2R,5R)-rel, 醋酸新戊酯
谱图信息:
最多检出来源 Macaca mulatta(otcml) 3.41%
分子结构信息
SMILES: CC(=O)OC1CC(C)CCC1C(C)C
InChI: InChI=1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3
描述信息
(±)-menthyl acetate, also known as dl-P-menth-3-yl acetate, is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes (±)-menthyl acetate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (±)-menthyl acetate can be found in cornmint, which makes (±)-menthyl acetate a potential biomarker for the consumption of this food product.
(±)-Menthyl acetate is found in cornmint. (±)-Menthyl acetate is a component of peppermint oil.
?Menthyl acetate (L-Menthyl acetate) is a derivative of L-menthol. ?Menthyl acetate is effective to enhance 5-aminolevulinic acid (ALA) skin permeation[1].
?Menthyl acetate (L-Menthyl acetate) is a derivative of L-menthol. ?Menthyl acetate is effective to enhance 5-aminolevulinic acid (ALA) skin permeation[1].
同义名列表
22 个代谢物同义名
(1S,2R,5S)-5-Methyl-2-(propan-2-yl)cyclohexyl acetic acid; (1S,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl acetate; (1S,2R,5S)-2-isopropyl-5-methylcyclohexyl acetate; (+)-Menthyl acetic acid; DL-p-Menth-3-yl acetate; (±)-menthyl acetic acid; (+/-)-Menthyl acetate; (DL)-Menthyl acetate; (+-)-Menthyl acetate; (+-)-Menthol acetate; (±)-Menthyl acetate; (+)-Menthyl acetate; (-)-Menthyl Acetate; l-menthyl acetate; Menthyl acetate; Menthyl acetate; Menthol acetate; (-)-Menthyl acetate; Menthyl acetate; Menthyl acetate; Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-; Neomenthyl acetate
数据库引用编号
29 个数据库交叉引用编号
- ChEBI: CHEBI:191550
- ChEBI: CHEBI:104
- KEGG: C09870
- PubChem: 220674
- PubChem: 27867
- HMDB: HMDB0041264
- Metlin: METLIN67978
- ChEMBL: CHEMBL2236867
- ChEMBL: CHEMBL254585
- KNApSAcK: C00036314
- foodb: FDB006041
- chemspider: 56127
- CAS: 29066-34-0
- CAS: 20777-36-0
- CAS: 16409-45-3
- CAS: 2230-87-7
- CAS: 2623-23-6
- CAS: 89-48-5
- PMhub: MS000021094
- PubChem: 12056
- KNApSAcK: C00000850
- 3DMET: B03337
- NIKKAJI: J71.002D
- medchemexpress: HY-N7132
- KNApSAcK: 104
- LOTUS: LTS0207854
- wikidata: Q72488412
- LOTUS: LTS0133438
- wikidata: Q6817577
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)
6 个相关的物种来源信息
- 9606 - Homo sapiens: -
- 69008 - Juniperus oxycedrus: 10.1135/CCCC19601656
- 294733 - Mentha canadensis: 10.1016/S0031-9422(01)00313-2
- 33090 - Plants: -
- 3677 - Trichosanthes kirilowii Maxim.: -
- 676073 - Trichosanthes rosthornii Harms: -
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
- Djamel Djenane, Mohammed Aïder, Javier Yangüela, Lamia Idir, Diego Gómez, Pedro Roncalés. Antioxidant and antibacterial effects of Lavandula and Mentha essential oils in minced beef inoculated with E. coli O157:H7 and S. aureus during storage at abuse refrigeration temperature.
Meat science.
2012 Dec; 92(4):667-74. doi:
10.1016/j.meatsci.2012.06.019
. [PMID: 22789458] - Asta Judzentiene, Rita Butkiene, Jurga Budiene, Félix Tomi, Joseph Casanova. Composition of seed essential oils of Rhododendron tomentosum.
Natural product communications.
2012 Feb; 7(2):227-30. doi:
. [PMID: 22474965]
- Jing Li, Jing Dong, Jia-Zhang Qiu, Jian-Feng Wang, Ming-Jing Luo, Hong-En Li, Bing-Feng Leng, Wen-Zhi Ren, Xu-Ming Deng. Peppermint oil decreases the production of virulence-associated exoproteins by Staphylococcus aureus.
Molecules (Basel, Switzerland).
2011 Feb; 16(2):1642-54. doi:
10.3390/molecules16021642
. [PMID: 21326141] - Rajesh Arora, R Chawla, Rohit Marwah, P Arora, R K Sharma, Vinod Kaushik, R Goel, A Kaur, M Silambarasan, R P Tripathi, J R Bhardwaj. Potential of Complementary and Alternative Medicine in Preventive Management of Novel H1N1 Flu (Swine Flu) Pandemic: Thwarting Potential Disasters in the Bud.
Evidence-based complementary and alternative medicine : eCAM.
2011; 2011(?):586506. doi:
10.1155/2011/586506
. [PMID: 20976081] - Jorge M S Faria, Inês S Nunes, A Cristina Figueiredo, Luis G Pedro, Helena Trindade, José G Barroso. Biotransformation of menthol and geraniol by hairy root cultures of Anethum graveolens: effect on growth and volatile components.
Biotechnology letters.
2009 Jun; 31(6):897-903. doi:
10.1007/s10529-009-9934-3
. [PMID: 19205895] - V Sfara, E N Zerba, Raúl A Alzogaray. Fumigant insecticidal activity and repellent effect of five essential oils and seven monoterpenes on first-instar nymphs of Rhodnius prolixus.
Journal of medical entomology.
2009 May; 46(3):511-5. doi:
10.1603/033.046.0315
. [PMID: 19496421] - Marina D Soković, Jelena Vukojević, Petar D Marin, Dejan D Brkić, Vlatka Vajs, Leo J L D van Griensven. Chemical composition of essential oils of Thymus and Mentha species and their antifungal activities.
Molecules (Basel, Switzerland).
2009 Jan; 14(1):238-49. doi:
10.3390/molecules14010238
. [PMID: 19136911] - George K Dresser, Vincent Wacher, Susan Wong, Harrison T Wong, David G Bailey. Evaluation of peppermint oil and ascorbyl palmitate as inhibitors of cytochrome P4503A4 activity in vitro and in vivo.
Clinical pharmacology and therapeutics.
2002 Sep; 72(3):247-55. doi:
10.1067/mcp.2002.126409
. [PMID: 12235445] - M Maffei, W Camusso, S Sacco. Effect of Mentha x piperita essential oil and monoterpenes on cucumber root membrane potential.
Phytochemistry.
2001 Nov; 58(5):703-7. doi:
10.1016/s0031-9422(01)00313-2
. [PMID: 11672734] - T Umezu, A Sakata, H Ito. Ambulation-promoting effect of peppermint oil and identification of its active constituents.
Pharmacology, biochemistry, and behavior.
2001 Jul; 69(3-4):383-90. doi:
10.1016/s0091-3057(01)00543-3
. [PMID: 11509195]