Cas no 203051-01-8 (Anguillosporal; (-)-form, 1',2'-Didehydro(E-))
203051-01-8 structure
Product Name:Anguillosporal; (-)-form, 1',2'-Didehydro(E-)
CAS No:203051-01-8
MF:C15H20O3
MW:248.317504882813
CID:2730290
PubChem ID:9859739
Update Time:2025-04-21
Anguillosporal; (-)-form, 1',2'-Didehydro(E-) Chemical and Physical Properties
Names and Identifiers
-
- 3-ethyl-6-[(E)-hex-2-en-2-yl]-2,4-dihydroxybenzaldehyde
- (E)-3-Ethyl-2,4-dihydroxy-6-(1-methyl-1-pentenyl)-benzaldehyde
- CRM-51005
- 3-ethyl-6-((Z)-hex-2-en-2-yl)-2,4-dihydroxybenzaldehyde
- Benzaldehyde, 3-ethyl-2,4-dihydroxy-6-((1E)-1-methyl-1-pentenyl)-
- 3-ethyl-6-[(Z)-hex-2-en-2-yl]-2,4-dihydroxybenzaldehyde
- VPQ60YC8B9
- Benzaldehyde, 3-ethyl-2,4-dihydroxy-6-(1-methyl-1-pentenyl)-, (E)-
- UNII-VPQ60YC8B9
- Q27291957
- Benzaldehyde, 3-ethyl-2,4-dihydroxy-6-((1E)-1-methyl-1-penten-1-yl)-
- 203051-01-8
- Anguillosporal; (-)-form, 1',2'-Didehydro(E-)
-
- Inchi： 1S/C15H20O3/c1-4-6-7-10(3)12-8-14(17)11(5-2)15(18)13(12)9-16/h7-9,17-18H,4-6H2,1-3H3/b10-7+
- InChI Key： BEEZXTYOZYXCKI-JXMROGBWSA-N
- SMILES： CCC/C=C(/C1C(C=O)=C(O)C(CC)=C(O)C=1)\C
Computed Properties
- Exact Mass: 248.14124450Da
- Monoisotopic Mass: 248.14124450Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 298
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.146
- Topological Polar Surface Area: 57.5?2
Anguillosporal; (-)-form, 1',2'-Didehydro(E-) Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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