Benzyl cinnamate (BioDeep_00000018126)
Main id: BioDeep_00000396898
human metabolite PANOMIX_OTCML-2023 natural product
代谢物信息卡片
化学式: C16H14O2 (238.09937440000002)
中文名称: 肉桂酸苄酯, 苯甲醇,肉桂酸盐, 2-丙酸,3-苯基-,苯基甲酯
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: C1=CC=C(C=C1)COC(=O)C=CC2=CC=CC=C2
InChI: InChI=1S/C16H14O2/c17-16(12-11-14-7-3-1-4-8-14)18-13-15-9-5-2-6-10-15/h1-12H,13H2/b12-11-
描述信息
Benzyl cinnamate is found in cumin. Benzyl cinnamate is isolated from various plant species. Benzyl cinnamate is present in Sumatra and Penang benzoin, Peru and tolu balsams, main constituent of copaiba balsam. Benzyl cinnamate is a flavouring agent.
Benzyl cinnamate is isolated from various plant spp.. It is found in Sumatra and Penang benzoin, Peru and tolu balsams, main constituent of copaiba balsam. Can be used as a flavouring agent.
Benzyl cinnamate, occurs in Balsam of Peru and Tolu balsam, in Sumatra and Penang benzoin, and as the main constituent of copaiba balsam, is used in heavy oriental perfumes and as a fixative[1].
Benzyl cinnamate, occurs in Balsam of Peru and Tolu balsam, in Sumatra and Penang benzoin, and as the main constituent of copaiba balsam, is used in heavy oriental perfumes and as a fixative[1].
同义名列表
19 个代谢物同义名
2-Propenoic acid, 3-phenyl-, phenylmethyl ester; 3-Phenyl-2-propenoic acid phenylmethyl ester; Benzyl laquo gammaraquo -phenylacrylate; Benzyl (2Z)-3-phenylprop-2-enoic acid; Benzyl (2E)-3-phenyl-2-propenoate; benzyl (2Z)-3-phenylprop-2-enoate; trans-Cinnamic acid benzyl ester; Benzylester kyseliny skoricove; Benzyl alcohol cinnamic ester; Cinnamic acid, benzyl ester; Benzyl 3-phenylpropenoate; Benzyl alcohol, cinnamate; Benzyl cinnamic acid; Benzyl cinnamate; Benzylcinnamate; Cinnamein; FEMA 2142; Benzyl alcohol, cinnamate; 2-Propenoic acid, 3-phenyl-, phenylmethyl ester
数据库引用编号
15 个数据库交叉引用编号
- PubChem: 15558051
- PubChem: 7652
- HMDB: HMDB0040286
- Wikipedia: Benzyl cinnamate
- KNApSAcK: C00019222
- foodb: FDB020007
- chemspider: 21391699
- CAS: 28541-02-8
- CAS: 103-41-3
- PMhub: MS000002692
- medchemexpress: HY-N7090
- LOTUS: LTS0194483
- wikidata: Q76506726
- LOTUS: LTS0261137
- LOTUS: LTS0167123
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)
48 个相关的物种来源信息
- 22140 - Annonaceae: LTS0167123
- 22140 - Annonaceae: LTS0261137
- 255932 - Balantiopsidaceae: LTS0167123
- 255932 - Balantiopsidaceae: LTS0261137
- 255998 - Balantiopsis: LTS0167123
- 255998 - Balantiopsis: LTS0261137
- 16906 - Cornus Officinalis Sieb. Et Zucc.: -
- 2759 - Eukaryota: LTS0167123
- 2759 - Eukaryota: LTS0261137
- 3803 - Fabaceae: LTS0167123
- 3803 - Fabaceae: LTS0261137
- 306958 - Friesodielsia: LTS0167123
- 306958 - Friesodielsia: LTS0261137
- 2027493 - Friesodielsia velutina: 10.1016/S0031-9422(00)95214-2
- 2027493 - Friesodielsia velutina: LTS0167123
- 2027493 - Friesodielsia velutina: LTS0261137
- 9606 - Homo sapiens: -
- 255933 - Isotachis: LTS0167123
- 255933 - Isotachis: LTS0261137
- 588648 - Isotachis japonica: 10.1016/S0031-9422(00)84505-7
- 588648 - Isotachis japonica: LTS0167123
- 588648 - Isotachis japonica: LTS0261137
- 186771 - Jungermanniopsida: LTS0167123
- 186771 - Jungermanniopsida: LTS0261137
- 3398 - Magnoliopsida: LTS0167123
- 3398 - Magnoliopsida: LTS0261137
- 3195 - Marchantiophyta: LTS0167123
- 3195 - Marchantiophyta: LTS0261137
- 33090 - Plants: -
- 4275 - Polygala: LTS0167123
- 174549 - Polygala senega: 10.1002/FFJ.2730100408
- 174549 - Polygala senega: LTS0167123
- 4274 - Polygalaceae: LTS0167123
- 35493 - Streptophyta: LTS0167123
- 35493 - Streptophyta: LTS0261137
- 20008 - Styracaceae: LTS0167123
- 13699 - Styrax: -
- 13699 - Styrax: LTS0167123
- 153524 - Styrax benzoin: 10.1002/PCA.1048
- 153524 - Styrax benzoin: LTS0167123
- 47097 - Tephrosia: LTS0167123
- 47097 - Tephrosia: LTS0261137
- 1835418 - Tephrosia sinapou: LTS0167123
- 1835418 - Tephrosia sinapou: LTS0261137
- 58023 - Tracheophyta: LTS0167123
- 58023 - Tracheophyta: LTS0261137
- 33090 - Viridiplantae: LTS0167123
- 33090 - Viridiplantae: LTS0261137
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
- Mark J Henderson, Kathleen A Trychta, Shyh-Ming Yang, Susanne Bäck, Adam Yasgar, Emily S Wires, Carina Danchik, Xiaokang Yan, Hideaki Yano, Lei Shi, Kuo-Jen Wu, Amy Q Wang, Dingyin Tao, Gergely Zahoránszky-Kőhalmi, Xin Hu, Xin Xu, David Maloney, Alexey V Zakharov, Ganesha Rai, Fumihiko Urano, Mikko Airavaara, Oksana Gavrilova, Ajit Jadhav, Yun Wang, Anton Simeonov, Brandon K Harvey. A target-agnostic screen identifies approved drugs to stabilize the endoplasmic reticulum-resident proteome.
Cell reports.
2021 04; 35(4):109040. doi:
10.1016/j.celrep.2021.109040
. [PMID: 33910017] - Tobie D Lee, Olivia W Lee, Kyle R Brimacombe, Lu Chen, Rajarshi Guha, Sabrina Lusvarghi, Bethilehem G Tebase, Carleen Klumpp-Thomas, Robert W Robey, Suresh V Ambudkar, Min Shen, Michael M Gottesman, Matthew D Hall. A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
Molecular pharmacology.
2019 11; 96(5):629-640. doi:
10.1124/mol.119.115964
. [PMID: 31515284] - Andrea Aliboni, Armando D'Andrea, Paolo Massanisso. Propolis specimens from different locations of central Italy: chemical profiling and gas chromatography-mass spectrometry (GC-MS) quantitative analysis of the allergenic esters benzyl cinnamate and benzyl salicylate.
Journal of agricultural and food chemistry.
2011 Jan; 59(1):282-8. doi:
10.1021/jf1034866
. [PMID: 21126078] - Mohamed Amine Diba, Julien Paolini, Mourad Bendahou, Laurent Varesi, Hocine Allali, Jean-Marie Desjobert, Boufeldja Tabti, Jean Costa. Chemical composition of fatty acid and unsaponifiable fractions of leaves, stems and roots of Arbutus unedo and in vitro antimicrobial activity of unsaponifiable extracts.
Natural product communications.
2010 Jul; 5(7):1085-90. doi:
"
. [PMID: 20734946] - Osamu Ohno, Mao Ye, Tomoyuki Koyama, Kazunaga Yazawa, Emi Mura, Hiroshi Matsumoto, Takao Ichino, Kaoru Yamada, Kazuhiko Nakamura, Tomohiro Ohno, Kohji Yamaguchi, Junji Ishida, Akiyoshi Fukamizu, Daisuke Uemura. Inhibitory effects of benzyl benzoate and its derivatives on angiotensin II-induced hypertension.
Bioorganic & medicinal chemistry.
2008 Aug; 16(16):7843-52. doi:
10.1016/j.bmc.2008.03.056
. [PMID: 18672373] - Young-Cheol Yang, Hoi-Seon Lee, Si Hyeock Lee, J Marshall Clark, Young-Joon Ahn. Ovicidal and adulticidal activities of Cinnamomum zeylanicum bark essential oil compounds and related compounds against Pediculus humanus capitis (Anoplura: Pediculicidae).
International journal for parasitology.
2005 Dec; 35(14):1595-600. doi:
10.1016/j.ijpara.2005.08.005
. [PMID: 16188263] - Dae Sik Jang, Eun Jung Park, Young-Hwa Kang, Michael E Hawthorne, Jose Schunke Vigo, James G Graham, Fernando Cabieses, Harry H S Fong, Rajendra G Mehta, John M Pezzuto, A Douglas Kinghorn. Potential cncer chemopreventive flavonoids from the stems of Tephrosia toxicaria.
Journal of natural products.
2003 Sep; 66(9):1166-70. doi:
10.1021/np0302100
. [PMID: 14510590]