Thujopsene (BioDeep_00000007582)

Secondary id: BioDeep_00000015436, BioDeep_00000227573, BioDeep_00000638543, BioDeep_00001875523

PANOMIX_OTCML-2023

代谢物信息卡片

(-)-thujopsene

化学式: C15H24 (204.18779039999998)
中文名称: 罗汉柏烯, 罗汉柏烯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1=CCC2(C)CCCC(C)(C)C23CC13
InChI: InChI=1S/C15H24/c1-11-6-9-14(4)8-5-7-13(2,3)15(14)10-12(11)15/h6,12H,5,7-10H2,1-4H3

描述信息

A thujopsene that has (S,S,S)-configuration.

同义名列表

3 个代谢物同义名

(-)-thujopsene; Thujopsene; Sesquichamene

数据库引用编号

14 个数据库交叉引用编号

ChEBI: CHEBI:9578
ChEBI: CHEBI:172928
KEGG: C09740
PubChem: 442402
PubChem: 97829
Metlin: METLIN53567
CAS: 470-40-6
PMhub: MS000020982
MetaboLights: MTBLC9578
PubChem: 11928
LipidMAPS: LMPR0103860001
KNApSAcK: C00003194
3DMET: B03239
NIKKAJI: J34.327G

分类词条

倍半萜类

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)

74 个相关的物种来源信息

13102 Juniperus rigida var. conferta: 10.1016/S0031-9422(00)88478-2
114268 Juniperus californica: 10.3891/ACTA.CHEM.SCAND.15-0713
62753 Juniperus procera: 10.3891/ACTA.CHEM.SCAND.15-0713
650144 Juniperus recurva: 10.1080/00021369.1977.10862448
177241 Juniperus thurifera: 10.1080/00021369.1977.10862448
89194 Thuja standishii: 10.1016/0305-1978(85)90081-X
58030 Chamaecyparis lawsoniana: 10.1016/0305-1978(85)90081-X
642302 Frullania falciloba: 10.1016/S0031-9422(02)00542-3
85954 Callitropsis nootkatensis: 10.1016/S0031-9422(00)85772-6
3589 Basella alba: 10.1016/0889-1575(91)90017-Z
40949 Angelica archangelica: 10.1021/JF00046A030
488003 Persicaria minor: 10.3390/MOLECULES191119220
1155347 Persicaria mitis: 10.3390/MOLECULES191119220
313948 Rhanterium epapposum: 10.1002/FFJ.2730020106
48106 Centella asiatica: 10.1080/10412905.1994.9698382
253513 Marsupella emarginata: 10.1016/S0031-9422(02)00214-5
48386 Perilla frutescens:
989928 Lepidozia fauriana: 10.1016/S0031-9422(01)00322-3
3702 Arabidopsis thaliana: 10.1111/J.1365-313X.2005.02417.X
99808 Chamaecyparis pisifera: 10.1016/S0031-9422(00)81063-8
13808 Bazzania trilobata: 10.1016/S0031-9422(99)00123-5
866613 Eugenia dysenterica: 10.1016/S0378-8741(00)00214-2
58046 Platycladus orientalis:
127999 Tanacetum parthenium: 10.1002/(SICI)1099-1026(199611)11:6<367::AID-FFJ598>3.0.CO;2-R
2743244 Croton sonderianus: 10.1021/JO00200A028
13727 Thujopsis dolabrata:
912369 Croton nitens: 10.1002/FFJ.2730060307
13415 Chamaecyparis obtusa: 10.1016/S0031-9422(00)80268-X
99809 Juniperus rigida: 10.1016/S0031-9422(00)88478-2
13614 Microbiota decussata: 10.1515/ZNC-2002-11-1208
28982 Taxodium distichum: 10.1080/10412905.1999.9701161
669713 Juniperus horizontalis: 10.1139/V61-339
1126 Microcystis aeruginosa: 10.1016/S0031-9422(97)00943-6
177241 Juniperus thurifera: 10.1055/S-2005-837753
650144 Juniperus recurva: 10.1271/BBB1961.41.201
1075059 Widdringtonia whytei: 10.1002/FFJ.2730030303
85712 Angelica gigas: 10.1021/JF802820D
13102 Juniperus rigida var. conferta: 10.1016/S0031-9422(00)88478-2
114268 Juniperus californica: 10.3891/ACTA.CHEM.SCAND.15-0713
62753 Juniperus procera: 10.3891/ACTA.CHEM.SCAND.15-0713
650144 Juniperus recurva: 10.1080/00021369.1977.10862448
177241 Juniperus thurifera: 10.1080/00021369.1977.10862448
89194 Thuja standishii: 10.1016/0305-1978(85)90081-X
58030 Chamaecyparis lawsoniana: 10.1016/0305-1978(85)90081-X
642302 Frullania falciloba: 10.1016/S0031-9422(02)00542-3
85954 Callitropsis nootkatensis: 10.1016/S0031-9422(00)85772-6
3589 Basella alba: 10.1016/0889-1575(91)90017-Z
40949 Angelica archangelica: 10.1021/JF00046A030
488003 Persicaria minor: 10.3390/MOLECULES191119220
1155347 Persicaria mitis: 10.3390/MOLECULES191119220
313948 Rhanterium epapposum: 10.1002/FFJ.2730020106
48106 Centella asiatica: 10.1080/10412905.1994.9698382
253513 Marsupella emarginata: 10.1016/S0031-9422(02)00214-5
48386 Perilla frutescens:
989928 Lepidozia fauriana: 10.1016/S0031-9422(01)00322-3
3702 Arabidopsis thaliana: 10.1111/J.1365-313X.2005.02417.X
99808 Chamaecyparis pisifera: 10.1016/S0031-9422(00)81063-8
13808 Bazzania trilobata: 10.1016/S0031-9422(99)00123-5
866613 Eugenia dysenterica: 10.1016/S0378-8741(00)00214-2
58046 Platycladus orientalis:
127999 Tanacetum parthenium: 10.1002/(SICI)1099-1026(199611)11:6<367::AID-FFJ598>3.0.CO;2-R
2743244 Croton sonderianus: 10.1021/JO00200A028
13727 Thujopsis dolabrata:
912369 Croton nitens: 10.1002/FFJ.2730060307
13415 Chamaecyparis obtusa: 10.1016/S0031-9422(00)80268-X
99809 Juniperus rigida: 10.1016/S0031-9422(00)88478-2
13614 Microbiota decussata: 10.1515/ZNC-2002-11-1208
28982 Taxodium distichum: 10.1080/10412905.1999.9701161
669713 Juniperus horizontalis: 10.1139/V61-339
1126 Microcystis aeruginosa: 10.1016/S0031-9422(97)00943-6
177241 Juniperus thurifera: 10.1055/S-2005-837753
650144 Juniperus recurva: 10.1271/BBB1961.41.201
1075059 Widdringtonia whytei: 10.1002/FFJ.2730030303
85712 Angelica gigas: 10.1021/JF802820D

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

Yuan Yuan, Ye Sun, Yanchun Zhao, Chungui Liu, Xiulan Chen, Fengtong Li, Jianzhong Bao. Identification of Floral Scent Profiles in Bearded Irises. Molecules (Basel, Switzerland). 2019 May; 24(9):. doi: 10.3390/molecules24091773. [PMID: 31067789]
Toshio Hasegawa, Kazuma Yoshitome, Takashi Fujihara, Mardi Santoso, Muhammad Abdul Aziz. Characteristic Changes in the Aroma Profile of Patchouli Depending on Manufacturing Process. Journal of oleo science. 2017 Aug; 66(8):863-869. doi: 10.5650/jos.ess17002. [PMID: 28701650]
Umberto Salvagnin, Silvia Carlin, Sergio Angeli, Urska Vrhovsek, Gianfranco Anfora, Mickael Malnoy, Stefan Martens. Homologous and heterologous expression of grapevine E-(β)-caryophyllene synthase (VvGwECar2). Phytochemistry. 2016 Nov; 131(?):76-83. doi: 10.1016/j.phytochem.2016.08.002. [PMID: 27561253]
Alessandra Manzo, Loana Musso, Sara Panseri, Marcello Iriti, Sabrina Dallavalle, Enrico Catalano, Giorgio Scarì, Annamaria Giorgi. Screening of the chemical composition and bioactivity of Waldheimia glabra (Decne.) Regel essential oil. Journal of the science of food and agriculture. 2016 Jul; 96(9):3195-201. doi: 10.1002/jsfa.7499. [PMID: 26467601]
Paul H Reeves, Christine M Ellis, Sara E Ploense, Miin-Feng Wu, Vandana Yadav, Dorothea Tholl, Aurore Chételat, Ina Haupt, Brian J Kennerley, Charles Hodgens, Edward E Farmer, Punita Nagpal, Jason W Reed. A regulatory network for coordinated flower maturation. PLoS genetics. 2012 Feb; 8(2):e1002506. doi: 10.1371/journal.pgen.1002506. [PMID: 22346763]
Ying-Ju Chen, Chun-Ya Lin, Seng-Sung Cheng, Shang-Tzen Chang. Phylogenetic relationships of the genus Chamaecyparis inferred from leaf essential oil. Chemistry & biodiversity. 2011 Jun; 8(6):1083-97. doi: 10.1002/cbdv.201000348. [PMID: 21674781]
Xueting Bai, Yicun Chen, Weizhou Chen, Huaping Lei, Ganggang Shi. Volatile constituents, inorganic elements and primary screening of bioactivity of black coral cigarette holders. Marine drugs. 2011; 9(5):863-78. doi: 10.3390/md9050863. [PMID: 21673895]
Yaqiong Qiu, Xin Lu, Tao Pang, Chenfei Ma, Xiang Li, Guowang Xu. Determination of radix ginseng volatile oils at different ages by comprehensive two-dimensional gas chromatography/time-of-flight mass spectrometry. Journal of separation science. 2008 Oct; 31(19):3451-7. doi: 10.1002/jssc.200800253. [PMID: 18803254]
Jae Kwak, Alan Willse, Koichi Matsumura, Maryanne Curran Opiekun, Weiguang Yi, George Preti, Kunio Yamazaki, Gary K Beauchamp. Genetically-based olfactory signatures persist despite dietary variation. PloS one. 2008; 3(10):e3591. doi: 10.1371/journal.pone.0003591. [PMID: 18974891]
Shuiqin Wu, Mark A Schoenbeck, Bryan T Greenhagen, Shunji Takahashi, Sungbeom Lee, Robert M Coates, Joseph Chappell. Surrogate splicing for functional analysis of sesquiterpene synthase genes. Plant physiology. 2005 Jul; 138(3):1322-33. doi: 10.1104/pp.105.059386. [PMID: 15965019]
Mirosława Krauze-Baranowska, Marek Mardarowicz, Marian Wiwart. The chemical composition of Microbiota decussata. Zeitschrift fur Naturforschung. C, Journal of biosciences. 2002 Nov; 57(11-12):998-1003. doi: 10.1515/znc-2002-11-1208. [PMID: 12562084]
A Srikrishna, K Anebouselvy. An enantiospecific approach to tricyclic sesquiterpenes mayurone and thujopsenes. The Journal of organic chemistry. 2001 Oct; 66(21):7102-6. doi: 10.1021/jo0105484. [PMID: 11597236]
B C Zhu, G Henderson, F Chen, H Fei, R A Laine. Evaluation of vetiver oil and seven insect-active essential oils against the Formosan subterranean termite. Journal of chemical ecology. 2001 Aug; 27(8):1617-25. doi: 10.1023/a:1010410325174. [PMID: 11521400]
T Jin, H Zhang, H Wang, Z Chen, H Zheng. [Constituent analysis of the essential oil in leaves of Torreya nucifera]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials. 1997 Nov; 20(11):563-8. doi: ". [PMID: 12572512]