cis-3-Hexenyl benzoate (BioDeep_00000026170)

human metabolite

代谢物信息卡片

Benzoic acid cis-3-hexenyl ester

化学式: C13H16O2 (204.1150236)
中文名称: 苯甲酸叶醇酯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: c1(C(=O)OCC/C=C\CC)ccccc1
InChI: InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3/b4-3-

描述信息

cis-3-Hexenyl benzoate is found in fruits. cis-3-Hexenyl benzoate is a constituent of black tea aroma. Also present in bilberry, lingon berry, cowberry and feijoa fruit and peel. cis-3-Hexenyl benzoate is a flavouring agent.
Constituent of black tea aromaand is also present in bilberry, lingon berry, cowberry and feijoa fruit and peel. Flavouring agent. cis-3-Hexenyl benzoate is found in tea and fruits.

同义名列表

20 个代谢物同义名

Benzoic acid cis-3-hexenyl ester; (3Z)-Hex-3-en-1-yl benzoic acid; 3-Hexenyl ester(Z)-benzoic acid; 3-Hexen-1-ol, benzoate, (3Z)-; (3Z)-hex-3-en-1-yl benzoate; cis-3-Hexenyl benzoic acid; (3Z)-3-Hexen-1-yl benzoate; (Z)-3-Hexen-1-ol benzoate; (Z)-3-Hexen-1-yl-benzoate; (Z)-3-Hexen-1-yl benzoate; Z-Hex-3-en-1-yl benzoate; cis-Hex-3-enyl benzoate; (3Z)-3-Hexenyl benzoate; (Z)-3-Hexenyl benzoate; cis-Hexenyl-3-benzoate; Hex-3(Z)-enyl benzoate; cis-3-Hexenyl benzoate; (3Z)-Hexenyl benzoate; cis-3-HEXENYLBENZOATE; FEMA 3688

数据库引用编号

10 个数据库交叉引用编号

ChEBI: CHEBI:156235
PubChem: 5367706
PubChem: 32809
HMDB: HMDB0033379
ChEMBL: CHEMBL3182851
KNApSAcK: C00029345
foodb: FDB011409
chemspider: 4519192
CAS: 25152-85-6
PMhub: MS000212962

分类词条

Benzoic acid esters

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)

21 个相关的物种来源信息

589713 Anthemis aciphylla: 10.1248/CPB.54.222
260130 Acca sellowiana: 10.3390/MOLECULES24112053
97693 Quercus agrifolia: 10.1016/S0031-9422(00)84047-9
180772 Vaccinium vitis-idaea: 10.3891/ACTA.CHEM.SCAND.21-2076
65561 Hypericum perforatum: 10.1080/14786411003792165
180772 Vaccinium vitis-idaea:
589713 Anthemis aciphylla: 10.1248/CPB.54.222
39347 Nepeta cataria: 10.1080/10412905.1993.9698195
97693 Quercus agrifolia: 10.1016/S0031-9422(00)84047-9
260130 Acca sellowiana: 10.1016/S0031-9422(00)97781-1
589713 Anthemis aciphylla: 10.1248/CPB.54.222
260130 Acca sellowiana: 10.3390/MOLECULES24112053
97693 Quercus agrifolia: 10.1016/S0031-9422(00)84047-9
180772 Vaccinium vitis-idaea: 10.3891/ACTA.CHEM.SCAND.21-2076
65561 Hypericum perforatum: 10.1080/14786411003792165
180772 Vaccinium vitis-idaea:
589713 Anthemis aciphylla: 10.1248/CPB.54.222
39347 Nepeta cataria: 10.1080/10412905.1993.9698195
97693 Quercus agrifolia: 10.1016/S0031-9422(00)84047-9
260130 Acca sellowiana: 10.1016/S0031-9422(00)97781-1
9606 Homo sapiens: -

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

D M Suckling, A M Twidle, A R Gibb, L M Manning, V J Mitchell, T E S Sullivan, S L Wee, A M El-Sayed. Volatiles from apple trees infested with light brown apple moth larvae attract the parasitoid Dolichogenidia tasmanica. Journal of agricultural and food chemistry. 2012 Sep; 60(38):9562-6. doi: 10.1021/jf302874g. [PMID: 22950817]
Shahrokh Bagheri-Gavkosh, Mohsen Bigdeli, Masoomeh Shams-Ghahfarokhi, Mehdi Razzaghi-Abyaneh. Inhibitory effects of Ephedra major Host on Aspergillus parasiticus growth and aflatoxin production. Mycopathologia. 2009 Nov; 168(5):249-55. doi: 10.1007/s11046-009-9220-x. [PMID: 19557546]
Ann M Fraser, Wendy L Mechaber, John G Hildebrand. Electroantennographic and behavioral responses of the sphinx moth Manduca sexta to host plant headspace volatiles. Journal of chemical ecology. 2003 Aug; 29(8):1813-33. doi: 10.1023/a:1024898127549. [PMID: 12956509]