Cinnamein (BioDeep_00000623426)

Main id: BioDeep_00000396898

 

PANOMIX_OTCML-2023


代谢物信息卡片


2-Propenoic acid, 3-phenyl-, phenylmethyl ester, (E)-

化学式: C16H14O2 (238.09937440000002)
中文名称: 肉桂酸苄酯
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, 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

49 个代谢物同义名

2-Propenoic acid, 3-phenyl-, phenylmethyl ester, (E)-; (E)-3-phenylprop-2-enoic acid phenylmethyl ester; 2-Propenoic acid, 3-phenyl-, phenylmethyl ester; 3-phenylprop-2-enoic acid phenylmethyl ester; 3-Phenyl-2-propenoic acid phenylmethyl ester; phenylmethyl (E)-3-phenylprop-2-enoate; Benzylester kyseliny skoricove [Czech]; (E)-3-phenylacrylic acid benzyl ester; 3-Phenyl-acrylic acid, benzyl ester; phenylmethyl 3-phenylprop-2-enoate; Phenylmethyl 3-phenyl-2-propenoate; Benzyl (2E)-3-phenyl-2-propenoate; 3-phenylacrylic acid benzyl ester; trans-Cinnamic acid benzyl ester; Benzyl alcohol, cinnamic ester; Benzyl .gamma.-phenylacrylate; Benzyl alcohol cinnamic ester; Cinnamic acid, benzyl ester; Benzyl gamma-phenylacrylate; Cinnamic acid benzyl ester; Benzyl 3-phenylpropenoate; Benzyl-3-phenylpropenoate; Cinnamic acid benzylester; Benzyl alcohol, cinnamate; Benzyl cinnamate; EINECS 203-109-3; Benzylcinnamoate; NCGC00166124-01; Benzylcinnamate; W214205_ALDRICH; 234214_ALDRICH; FEMA No. 2142; WLN: R1U1VO1R; ZINC01718575; 96370_FLUKA; AIDS-224206; AIDS224206; Cinnamein; 8014-16-2; NSC 11780; AI3-01268; NSC11780; 103-41-3; HSDB 359; NSC44403; Benzyl laquo gammaraquo -phenylacrylate; benzyl (2Z)-3-phenylprop-2-enoate; Benzylester kyseliny skoricove; FEMA 2142



数据库引用编号

11 个数据库交叉引用编号

分类词条

相关代谢途径

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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)

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

  • Aslı Deniz Aydın, Faruk Altınel, Hüseyin Erdoğmuş, Çağdaş Devrim Son. Allergen fragrance molecules: a potential relief for COVID-19. BMC complementary medicine and therapies. 2021 Jan; 21(1):41. doi: 10.1186/s12906-021-03214-4. [PMID: 33478471]
  • Juliana Maria de Mello Andrade, Carolina Dos Santos Passos, Maria Angélica Kieling Rubio, Jacqueline Nakau Mendonça, Norberto Peporine Lopes, Amélia Teresinha Henriques. Combining in vitro and in silico approaches to evaluate the multifunctional profile of rosmarinic acid from Blechnum brasiliense on targets related to neurodegeneration. Chemico-biological interactions. 2016 Jul; 254(?):135-45. doi: 10.1016/j.cbi.2016.06.005. [PMID: 27270453]
  • Andreas Natsch, Tina Haupt, Heike Laue. Relating skin sensitizing potency to chemical reactivity: reactive Michael acceptors inhibit NF-κB signaling and are less sensitizing than S(N)Ar- and S(N)2- reactive chemicals. Chemical research in toxicology. 2011 Nov; 24(11):2018-27. doi: 10.1021/tx2003678. [PMID: 22023385]
  • 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]
  • 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]