beta-Sesquiphellandrene (BioDeep_00000843648)

PANOMIX_OTCML-2023

代谢物信息卡片

(-)-beta-Sesquiphellandrene

化学式: C15H24 (204.18779039999998)
中文名称: Β- 倍半水芹烯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C1=C[C@H](CCC1=C)[C@H](CCC=C(C)C)C
InChI: InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,10,14-15H,3,5,7,9,11H2,1-2,4H3/t14-,15+/m0/s1

描述信息

A sesquiterpene that is cyclohexene in which the hydrogens at position 6 are replaced by a methylidene group and in which the pro-R hydrogen at position 3 is replaced by a (2S)-6-methylhept-5-en-2-yl group.

同义名列表

2 个代谢物同义名

(-)-beta-Sesquiphellandrene; beta-Sesquiphellandrene

数据库引用编号

9 个数据库交叉引用编号

ChEBI: CHEBI:64361
KEGG: C16776
PubChem: 12315492
KNApSAcK: C00007630
CAS: 20307-83-9
CAS: 1353-10-2
MetaboLights: MTBLC64361
PubChem: 96023300
NIKKAJI: J15.534I

分类词条

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)

45 个相关的物种来源信息

133233 - Achillea ptarmica: 10.1055/S-2006-960180
4465 - Acorus calamus: 10.1016/J.PHYTOCHEM.2005.01.007
68299 - Ageratum conyzoides: 10.1080/10412905.1993.9698184
518704 - Alpinia chinensis:
105671 - Alpinia conchigera: 10.1080/10412905.1995.9698499
94327 - Alpinia galanga: 10.1016/S0031-9422(00)80814-6
3702 - Arabidopsis thaliana: 10.1111/J.1365-313X.2005.02417.X
385370 - Aster scaber: 10.1021/JF00034A033
2707381 - Baccharis articulata: 10.1016/S0031-9422(00)83061-7
2321251 - Baccharis linearifolia: 10.1016/S0031-9422(00)83061-7
373805 - Calypogeia suecica: 10.1016/S0031-9422(99)00081-3
48106 - Centella asiatica: 10.1080/10412905.1994.9698382
187461 - Chamaecyparis formosensis: 10.1016/S0031-9422(99)00074-6
2706 - Citrus: 10.1080/10412905.1993.9698179
558547 - Citrus deliciosa: 10.3390/MOLECULES21060814
85571 - Citrus reticulata: 10.3390/MOLECULES21060814
37690 - Citrus trifoliata: 10.3390/MOLECULES21060814
91242 - Conyza bonariensis: 10.1080/14786419.2010.513685
72917 - Conyza canadensis: 10.1016/0031-9422(88)80461-8
462400 - Culcitium canescens: 10.1016/S0031-9422(00)97558-7
136217 - Curcuma longa:
136222 - Curcuma xanthorrhiza: 10.1248/YAKUSHI1947.112.11_817
72917 - Erigeron canadensis: 10.1016/0031-9422(88)80461-8
102771 - Eupatorium capillifolium: 10.1080/10412905.1998.9700844
103972 - Fitzroya cupressoides: 10.1016/0031-9422(96)00109-4
165083 - Gundelia tournefortii: 10.1080/13880200500220268
112363 - Helichrysum odoratissimum: 10.1080/10412905.1993.9698235
126435 - Lantana camara: 10.1002/(SICI)1099-1026(199901/02)14:1<15::AID-FFJ777>3.0.CO;2-M
649173 - Lantana strigocamara: 10.1002/(SICI)1099-1026(199901/02)14:1<15::AID-FFJ777>3.0.CO;2-M
2126591 - Ligularia amplexicaulis: 10.1016/S0031-9422(00)83943-6
349376 - Marchantia chenopoda: 10.1016/S0031-9422(00)97015-8
2006539 - Mosla cavaleriei: 10.1080/10412905.1995.9698478
882374 - Onoseris onoseroides: 10.1016/0031-9422(89)80344-9
39352 - Origanum vulgare: 10.1080/10412905.1993.9698253
158596 - Pelargonium endlicherianum: 10.1055/S-2006-960872
204156 - Platostoma africanum: 10.1055/S-2006-962093
264783 - Plicanthus hirtellus: 10.1016/J.TET.2009.03.026
4113 - Solanum tuberosum: 10.1055/S-2007-969499
59297 - Solidago canadensis: 10.1055/S-2006-959673
547782 - Symphyotrichum undulatum: 10.1021/JF00034A033
1194133 - Thymus longicaulis:
54477 - Vitex agnus-castus:
336856 - Zingiber montanum:
94328 - Zingiber officinale:
857215 - Zingiber purpureum: 10.1248/CPB.57.1267

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。