β-桉叶醇 | 473-15-4
中文名称:
β-桉叶醇
英文名称:
β-Eudesmol Standard
CAS No.:
473-15-4
分子式:
C1 5 H2 6 O
分子量:
222.3663
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:β-桉叶醇结构式
名称和标识符
MDL
MFCD00210502
InChIKey
BOPIMTNSYWYZOC-VNHYZAJKSA-N
Inchi
1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h12-13,16H,1,5-10H2,2-4H3/t12-,13+,15-/m1/s1
SMILES
O([H])C(C([H])([H])[H])(C([H])([H])[H])[C@]1([H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C(=C([H])[H])[C@]2([H])C1([H])[H]
别名信息
- 中文别名 -
beta-桉叶醇
beta-桉叶油醇
β-桉叶醇
β-桉叶醇
β-桉油醇
β-桉叶醇标准品
- 英文别名 -
beta-Eudesmol
(2R,4aR,8aS)-Decahydro-8-methylene-alpha,alpha,4a-trimethyl-2-naphthylmethanol
2-[(2R,4aR,8aS)-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-ol
EUDESMOL, B-(RG)
β-Eudesmol
(2R,4aR,8aS)-Decahydro-8-methylene-α,α,4a-trimethyl-2-naphthylmethanol
A-Eudesmol
b-eudesmol
Eudesm-4(14)-en-11-ol
Eudesmol. B.
WAKO056-05161
beta-Selinenol
C15H26O
6R61524P48
.beta.-Eudesmol
2-[(2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl]propan-2-ol
2-Naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, (2R,4aR,8aS)-
2-Naphthalenemethanol, decahydro-8-methylene-alpha,alpha,4a-trimethyl-, (2R-(2-alpha,4a-alpha,8a-beta)-
2-Naphthalenemethanol
β-Eudesmol Standard
beta -Eudesmol
beta -Eudesmol
beta-Eudesmol, >=90% (GC)
beta-Eudesmol, >=90% (GC)
CS-0032182
CS-0032182
NS00094764
NS00094764
4(15)-Selinen-11-ol
CHEBI:10417
4(15)-Selinen-11-ol
(+)-.BETA.-EUDESMOL
3-Fluoro-4-cyanophenyltrans-4-(4-n-propylcyclohexyl)-benzoate
CHEBI:10417
2-Naphthalenemethanol, decahydro-.alpha.,.alpha.,4a-trimethyl-8-methylene-, [2R-(2.alpha.,4a.alpha.,8a.beta.)]-
(+)-.BETA.-EUDESMOL
2-NAPHTHALENEMETHANOL, DECAHYDRO-.ALPHA.,.ALPHA.,4A-TRIMETHYL-8-METHYLENE-, (2R-(2.ALPHA.,4A.ALPHA.,8A.BETA.))-
3-Fluoro-4-cyanophenyltrans-4-(4-n-propylcyclohexyl)-benzoate
2-Naphthalenemethanol, decahydro-.alpha.,.alpha.,4a-trimethyl-8-methylene-, (2R,4aR,8aS)-
2-Naphthalenemethanol, decahydro-.alpha.,.alpha.,4a-trimethyl-8-methylene-, [2R-(2.alpha.,4a.alpha.,8a.beta.)]-
SCHEMBL310604
2-NAPHTHALENEMETHANOL, DECAHYDRO-.ALPHA.,.ALPHA.,4A-TRIMETHYL-8-METHYLENE-, (2R-(2.ALPHA.,4A.ALPHA.,8A.BETA.))-
.beta.-Selinenol
C09664
2-Naphthalenemethanol, decahydro-.alpha.,.alpha.,4a-trimethyl-8-methylene-, (2R,4aR,8aS)-
MS-23247
SCHEMBL310604
AKOS030254844
2-Naphthalenemethanol, 1,2alpha,3,4,4a,5,6,7,8,8aalpha-decahydro-alpha,alpha,4abeta-trimethyl-8-methylene-
.beta.-Selinenol
473-15-4
C09664
2-((2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl)propan-2-ol
MS-23247
HY-N6018
AKOS030254844
2-((2R,4aR,8aS)-4a-methyl-8-methylenedecahydronaphthalen-2-yl)propan-2-ol
2-Naphthalenemethanol, 1,2alpha,3,4,4a,5,6,7,8,8aalpha-decahydro-alpha,alpha,4abeta-trimethyl-8-methylene-
BDBM50529606
473-15-4
(+)-beta-EUDESMOL
2-((2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl)propan-2-ol
2-Naphthalenemethanol, 1,2.alpha.,3,4,4a,5,6,7,8,8a.alpha.-decahydro-.alpha.,.alpha.,4a.beta.-trimethyl-8-methylene-
HY-N6018
beta-EUDESMOL, (+)-
2-((2R,4aR,8aS)-4a-methyl-8-methylenedecahydronaphthalen-2-yl)propan-2-ol
UNII-6R61524P48
BDBM50529606
.BETA.-EUDESMOL, (+)-
-eudesmol
(+)-beta-EUDESMOL
DTXSID60883391
2-Naphthalenemethanol, 1,2.alpha.,3,4,4a,5,6,7,8,8a.alpha.-decahydro-.alpha.,.alpha.,4a.beta.-trimethyl-8-methylene-
BOPIMTNSYWYZOC-VNHYZAJKSA-N
beta-EUDESMOL, (+)-
Q27108630
UNII-6R61524P48
CHEMBL88244
.BETA.-EUDESMOL, (+)-
2-NAPHTHALENEMETHANOL, DECAHYDRO-alpha,alpha,4A-TRIMETHYL-8-METHYLENE-, (2R-(2alpha,4Aalpha,8Abeta))-
-eudesmol
DTXSID60883391
BOPIMTNSYWYZOC-VNHYZAJKSA-N
Q27108630
CHEMBL88244
2-NAPHTHALENEMETHANOL, DECAHYDRO-alpha,alpha,4A-TRIMETHYL-8-METHYLENE-, (2R-(2alpha,4Aalpha,8Abeta))-
物化性质
实验特性
LogP
3.92000
PSA
20.23000
折射率
1.498
沸点
301.7°Cat760mmHg
熔点
72-74 °C (lit.)
闪点
108.6°C
颜色与性状
Cryst.
溶解性
未确定
密度
0.95
计算特性
精确分子量
222.19800
氢键供体数量
1
氢键受体数量
1
可旋转化学键数量
1
同位素质量
222.198365449 g/mol
重原子数量
16
复杂度
292
同位素原子数量
0
确定原子立构中心数量
3
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
3.7
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
20.2
分子量
222.37
相关文献
1.
576. The isomeric eudesmols and their association with carissone in Eucalyptus macarthuri
F. J. McQuillin,J. D. Parrack J. Chem. Soc. 1956 2973
2.
Green corrosion inhibitors for aluminium and its alloys: a review
Klodian Xhanari,Matja? Fin?gar,Ma?a Knez Hrn?i?,Uro? Maver,?eljko Knez,Bujar Seiti RSC Adv. 2017 7 27299
3.
Overview of sesquiterpenes and chromones of agarwood originating from four main species of the genus Aquilaria
Mei Gao,Xiaomin Han,Ying Sun,Hongjiang Chen,Yun Yang,Yangyang Liu,Hui Meng,Zhihui Gao,Yanhong Xu,Zheng Zhang,Jianping Han RSC Adv. 2019 9 4113
4.
Matrix-assisted laser desorption/ionization time-of-flight mass spectrometry combined with chemometrics to identify the origin of Chinese medicinal materials
Huan Fang,Yue Chen,Hai-Long Wu,Yao Chen,Tong Wang,Jian Yang,Hai-Yan Fu,Xiao-Long Yang,Xu-Fu Li,Ru-Qin Yu RSC Adv. 2022 12 16886
5.
514. Synthetical experiments in the eudalene group of bicyclic sesquiterpenes. Part I. Synthesis of carissone and γ-eudesmol
A. R. Pinder,R. A. Williams J. Chem. Soc. 1963 2773
6.
Volatiles from nineteen recently genome sequenced actinomycetes
Christian A. Citron,Lena Barra,Joachim Wink,Jeroen S. Dickschat Org. Biomol. Chem. 2015 13 2673
7.
Production of flavorful alcohols from woods and possible applications for wood brews and liquors
Yuichiro Otsuka,Masanobu Nojiri,Norihisa Kusumoto,Ronald R. Navarro,Koh Hashida,Naoyuki Matsui RSC Adv. 2020 10 39753
8.
A systematic approach to prioritize drug targets using machine learning, a molecular descriptor-based classification model, and high-throughput screening of plant derived molecules: a case study in oral cancer
Vinay Randhawa,Anil Kumar Singh,Vishal Acharya Mol. BioSyst. 2015 11 3362
9.
Bacterial terpene cyclases
Jeroen S. Dickschat Nat. Prod. Rep. 2016 33 87
10.
Walnut green husk ethanol extract improves gut microbiota and their metabolites associated with NLRP3 in non-alcoholic steatohepatitis
Qionglian Fang,Xinping Li,Mengmeng Wang,Xue Qiao,Feng Huang,Chunyan Hu,Yongmei Xue,Shenglan Zhao,Yuping Lin Food Funct. 2022 13 6387
β-桉叶醇推荐生产厂家
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