InChIKey | ADFWQBGTDJIESE-UHFFFAOYSA-N |
Inchi | InChI=1S/C22H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(23)21(19)22(24)25/h15,17-18,23H,2-14,16H2,1H3,(H,24,25) |
SMILES | O=C(O)C1=C(CCCCCCCCCCCCCCC)C=CC=C1O |
LogP | 6.72410 |
PSA | 57.53000 |
折射率 | 1.514 |
沸点 | 474.8°C at 760 mmHg |
熔点 | 90-91 ºC |
闪点 | 255.1°C |
溶解度 | DMSO: ≥20mg/mL |
颜色与性状 | Powder |
溶解性 | DMSO: ≥20mg/mL |
密度 | 1.002 |
精确分子量 | 348.26600 |
氢键供体数量 | 2 |
氢键受体数量 | 3 |
可旋转化学键数量 | 15 |
同位素质量 | 348.266 |
重原子数量 | 25 |
复杂度 | 329 |
同位素原子数量 | 0 |
确定原子立构中心数量 | 0 |
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) | 9.5 |
拓扑分子极性表面积 | 57.5A^2 |
分子量 | 348.5 |
MDL | MFCD07368254 |
海关编码 | 2918290000 |
海关数据 |
中国海关编码:2918290000概述:2918290000 其他含酚基但不含其他含氧基羧酸及其酸酐、酰卤化物、过氧化物和过氧酸及它们的衍生物。监管条件:AB(入境货物通关单,出境货物通关单)。增值税率:17.0%。退税率:9.0%。最惠国关税:6.5%。普通关税:30.0% 申报要素:品名, 成分含量, 用途 监管条件:
A.入境货物通关单 检验检疫类别:
R.进口食品卫生监督检验 Summary:HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0% |
用途 | 抗菌 |
1.
Long-chain phenols. Part 18. Conversion of anacardic acid into urushiol
Lam Soot Kiong,John H. P. Tyman J. Chem. Soc. Perkin Trans. 1 1981 1942
2.
Fragmentation method reveals a wide spectrum of intramolecular hydrogen bond energies in antioxidant natural products
Vijay Singh,Ibrahim Ibnusaud,Shridhar R. Gadre,Milind M. Deshmukh New J. Chem. 2020 44 5841
3.
Long chain phenols. Part 15. Synthesis of 6-n-alkylsalicylic acids (and isomeric acids) from fluoroanisoles with alkyl-lithium
Aziz A. Durrani,John H. P. Tyman J. Chem. Soc. Perkin Trans. 1 1979 2079
4.
Phenylephrine-induced cardiac hypertrophy is attenuated by a histone acetylase inhibitor anacardic acid in mice
Chang Peng,Xiaomei Luo,Shuo Li,Huichao Sun Mol. BioSyst. 2017 13 714
5.
Structure, synthesis, biosynthesis, and activity of the characteristic compounds from Ginkgo biloba L.
Xin-Guang Liu,Xu Lu,Wen Gao,Ping Li,Hua Yang Nat. Prod. Rep. 2022 39 474
6.
Long-chain phenols. Part 14. Synthesis of 6-n-alkylsalicylic acids and 3-n-alkylphenols
Aziz A. Durrani,John H. P. Tyman J. Chem. Soc. Perkin Trans. 1 1979 2069
7.
The synthesis, spectroscopy and X-ray single crystal structure of catena-[(μ-anacardato)-copper(ii)bipyridine][Cu2{(μ-O2CC6H3(o-OH)(o-C15H31)}4(NC5H5)2]
Mohammad Azad Malik,Paul O'Brien,Floriana Tuna,Robin Pritchard,Joseph Buchweishaija,Elianaso Kimambo,Egid B. Mubofu Dalton Trans. 2013 42 14438
8.
Synthesis of tsetse fly attractants from a cashew nut shell extract by isomerising metathesis
S. Baader,P. E. Podsiadly,D. J. Cole-Hamilton,L. J. Goossen Green Chem. 2014 16 4885
9.
Non-isoprenoid long chain phenols
J. H. P. Tyman Chem. Soc. Rev. 1979 8 499
10.
Selective ethenolysis and oestrogenicity of compounds from cashew nut shell liquid
Jennifer Julis,Stuart A. Bartlett,Sabrina Baader,Nicola Beresford,Edwin J. Routledge,Catherine S. J. Cazin,David J. Cole-Hamilton Green Chem. 2014 16 2846