(1R,4S,5R)-4-Thujanol (BioDeep_00000019512)
Secondary id: BioDeep_00000004926
human metabolite Endogenous
代谢物信息卡片
(1R,2S,5R)-2-methyl-5-(propan-2-yl)bicyclo[3.1.0]hexan-2-ol
化学式: C10H18O (154.1358)
中文名称: 水合沙比宁, 顺式-（+/-）-4-Thujanol
谱图信息:
最多检出来源 Homo sapiens(plant) 9.02%
分子结构信息
SMILES: CC(C)C12CCC(C)(O)C1C2
InChI: InChI=1S/C10H18O/c1-7(2)10-5-4-9(3,11)8(10)6-10/h7-8,11H,4-6H2,1-3H3
描述信息
(1R,4S,5R)-4-Thujanol is found in herbs and spices. (1R,4S,5R)-4-Thujanol is a constituent of the essential oil of American peppermint and other Mentha species (1R,4S,5R)-4-Thujanol is a flavouring agent
Constituent of the essential oil of American peppermint and other Mentha subspecies Flavouring agent. (1R,4S,5R)-4-Thujanol is found in herbs and spices.
同义名列表
数据库引用编号
18 个数据库交叉引用编号
- ChEBI: CHEBI:16377
- KEGG: C02462
- PubChem: 12315154
- PubChem: 11744854
- PubChem: 62367
- HMDB: HMDB0036112
- KNApSAcK: C00000821
- foodb: FDB014959
- chemspider: 35014098
- CAS: 546-79-2
- PMhub: MS000017567
- PubChem: 5479
- LipidMAPS: LMPR0102120006
- KNApSAcK: C00000830
- CAS: 15537-55-0
- 3DMET: B01574
- NIKKAJI: J321.027H
- KNApSAcK: 16377
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)
56 个相关的物种来源信息
- 97169 - Abies sibirica: 10.1007/BF00600860
- 109081 - Anthriscus nitida: 10.1016/0305-1978(95)00058-5
- 259893 - Artemisia argyi: 10.1007/S11418-007-0175-2
- 265783 - Artemisia capillaris: 10.1007/S11418-007-0175-2
- 1473222 - Artemisia cina: 10.1007/S11418-007-0175-2
- 401898 - Artemisia gmelinii: 10.1007/S11418-007-0175-2
- 669134 - Artemisia montana: 10.1007/S11418-007-0175-2
- 223870 - Artemisia princeps: 10.1007/S11418-007-0175-2
- 466060 - Artemisia salsoloides: 10.1002/FFJ.2730070603
- 4220 - Artemisia vulgaris: 10.1007/BF00600857
- 146995 - Chrysanthemum indicum:
- 558547 - Citrus deliciosa: 10.1002/HLCA.19630460506
- 558547 - Citrus deliciosa: 10.1016/J.PHYTOCHEM.2009.07.031
- 171251 - Citrus medica: 10.1016/J.PHYTOCHEM.2009.07.031
- 85571 - Citrus reticulata: 10.1002/HLCA.19630460506
- 85571 - Citrus reticulata: 10.1016/J.PHYTOCHEM.2009.07.031
- 518876 - Croton sarcopetalus: 10.1021/NP990292L
- 3369 - Cryptomeria japonica: 10.1080/10412905.1991.9697930
- 698833 - Elsholtzia fruticosa: 10.1055/S-2006-961490
- 282213 - Hippolytia dolichophylla: 10.1016/S0031-9422(02)00396-5
- 9606 - Homo sapiens: -
- 16752 - Houttuynia cordata: 10.3390/MOLECULES200610298
- 3326 - Larix laricina: 10.1021/NP50050A051
- 71405 - Larix lyallii: 10.1021/NP50050A051
- 3327 - Larix occidentalis: 10.1021/NP50050A051
- 85223 - Laurus nobilis: 10.1007/BF00600858
- 164405 - Melaleuca alternifolia: 10.1016/S0031-9422(02)00038-9
- 164405 - Melaleuca alternifolia: 10.1021/JF00034A020
- 1945650 - Micromeria maderensis: 10.1002/FFJ.2730100313
- 306399 - Micromeria teneriffae: 10.1080/10412905.1991.9697971
- 54731 - Nepeta racemosa: 10.1080/10412905.1993.9698205
- 39350 - Ocimum basilicum: 10.1002/1099-1026(200009/10)15:5<339::AID-FFJ922>3.0.CO;2-H
- 204144 - Ocimum gratissimum: 10.1002/1099-1026(200009/10)15:5<339::AID-FFJ922>3.0.CO;2-H
- 204145 - Ocimum gratissimum var. gratissimum: 10.1002/1099-1026(200009/10)15:5<339::AID-FFJ922>3.0.CO;2-H
- 497761 - Origanum dictamnus: 10.1055/S-2006-962640
- 268884 - Origanum majorana: 10.1016/0003-9861(88)90328-1
- 1268194 - Origanum minutiflorum: 10.1080/10412905.1991.9697982
- 1132404 - Origanum sipyleum: 10.1080/10412905.1992.9698035
- 1082757 - Origanum syriacum: 10.1080/10412905.1991.9697923
- 39352 - Origanum vulgare: 10.1080/10412905.1993.9698253
- 308680 - Picea koraiensis: 10.1007/BF00579987
- 162307 - Picea schrenkiana: 10.1007/BF00600859
- 77912 - Pinus densiflora: 10.1007/BF00574326
- 13216 - Piper nigrum: 10.3390/MOLECULES24234244
- 174549 - Polygala senega: 10.1002/FFJ.2730100408
- 105903 - Rhododendron mucronulatum: 10.1007/BF01386197
- 38868 - Salvia officinalis: 10.1016/0003-9861(87)90436-X
- 39367 - Salvia rosmarinus: 10.1002/FFJ.2730090107
- 546409 - Satureja cuneifolia: 10.1016/S0031-9422(00)90514-4
- 127999 - Tanacetum parthenium: 10.1002/(SICI)1099-1026(199611)11:6<367::AID-FFJ598>3.0.CO;2-R
- 751869 - Thymus broussonetii: 10.1080/10412905.1993.9698169
- 2878271 - Thymus camphoratus: 10.1016/S0031-9422(97)00117-9
- 1194133 - Thymus longicaulis: 10.1080/10412905.1993.9698222
- 228974 - Thymus quinquecostatus: 10.17660/ACTAHORTIC.2005.678.19
- 751874 - Thymus saturejoides: 10.1080/10412905.1993.9698169
- 49992 - Thymus vulgaris: 10.17660/ACTAHORTIC.2005.678.19
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
- Dineshkumar Kandasamy, Rashaduz Zaman, Yoko Nakamura, Tao Zhao, Henrik Hartmann, Martin N Andersson, Almuth Hammerbacher, Jonathan Gershenzon. Conifer-killing bark beetles locate fungal symbionts by detecting volatile fungal metabolites of host tree resin monoterpenes.
PLoS biology.
2023 02; 21(2):e3001887. doi:
10.1371/journal.pbio.3001887. [PMID: 36802386] - Anna Jirošová, Blanka Kalinová, Roman Modlinger, Rastislav Jakuš, C Rikard Unelius, Miroslav Blaženec, Fredrik Schlyter. Anti-attractant activity of (+)-trans-4-thujanol for Eurasian spruce bark beetle Ips typographus: Novel potency for females.
Pest management science.
2022 May; 78(5):1992-1999. doi:
10.1002/ps.6819. [PMID: 35104043] - Christian Schiebe, C Rikard Unelius, Suresh Ganji, Muhammad Binyameen, Göran Birgersson, Fredrik Schlyter. Styrene, (+)-trans-(1R,4S,5S)-4-Thujanol and Oxygenated Monoterpenes Related to Host Stress Elicit Strong Electrophysiological Responses in the Bark Beetle Ips typographus.
Journal of chemical ecology.
2019 Jun; 45(5-6):474-489. doi:
10.1007/s10886-019-01070-8. [PMID: 31053976] - Saoussen Hammami, Ridha El Mokni, Khaled Faidi, Mohamed Hédi El Aouni, Zine Mighri, Rajesh K Joshi. Volatile Profile of Herniaria fontanesii Growing Spontaneously in Tunisia.
Journal of chromatographic science.
2016 Mar; 54(3):291-4. doi:
10.1093/chromsci/bmv158. [PMID: 26538491] - Erich Schmidt, Jürgen Wanner, Martina Hiiferl, Leopold Jirovetz, Gerhard Buchbauer, Velizar Gochev, Tania Girova, Albena Stoyanova, Margit Geissler. Chemical composition, olfactory analysis and antibacterial activity of Thymus vulgaris chemotypes geraniol, 4-thujanol/terpinen-4-ol, thymol and linalool cultivated in southern France.
Natural product communications.
2012 Aug; 7(8):1095-8. doi:
. [PMID: 22978238] - Olfa Baâtour, Imen Tarchoune, Hela Mahmoudi, Nawel Nassri, Wissal Abidi, Rym Kaddour, Ghaith Hamdaoui, Mouhiba Ben Nasri-Ayachi, Mohtar Lachaâl, Brahim Marzouk. Culture conditions and salt effects on essential oil composition of sweet marjoram (Origanum majorana) from Tunisia.
Acta pharmaceutica (Zagreb, Croatia).
2012 Jun; 62(2):251-61. doi:
10.2478/v10007-012-0019-9. [PMID: 22750822] - S Santoyo, S Cavero, L Jaime, E Ibañez, F J Señoráns, G Reglero. Supercritical carbon dioxide extraction of compounds with antimicrobial activity from Origanum vulgare L.: determination of optimal extraction parameters.
Journal of food protection.
2006 Feb; 69(2):369-75. doi:
10.4315/0362-028x-69.2.369. [PMID: 16496578] - Dale Shelton, Dimitrios Zabaras, Shahid Chohan, S Grant Wyllie, Peter Baverstock, David Leach, Robert Henry. Isolation and partial characterisation of a putative monoterpene synthase from Melaleuca alternifolia.
Plant physiology and biochemistry : PPB.
2004 Dec; 42(11):875-82. doi:
10.1016/j.plaphy.2004.10.010. [PMID: 15694281] - Simon Muhoho Njoroge, Hiroyuki Ukeda, Masayoshi Sawamura. Changes of the volatile profile and artifact formation in Daidai (Citrus aurantium) cold-pressed peel oil on storage.
Journal of agricultural and food chemistry.
2003 Jul; 51(14):4029-35. doi:
10.1021/jf021215q. [PMID: 12822942]
