Cas no 110562-14-6 (gloeosporone)
gloeosporone structure
Product Name:gloeosporone
CAS No:110562-14-6
MF:C18H30O5
MW:326.427806377411
CID:2001463
PubChem ID:14160703
Update Time:2025-04-21
gloeosporone Chemical and Physical Properties
Names and Identifiers
-
- gloeosporone
- 5-hydroxy-5-[2-(8-pentyloxocan-2-yl)acetyl]oxolan-2-one
- 5-Hydroxy-5-[(8-pentyloxocan-2-yl)acetyl]oxolan-2-one
- CHEBI:206564
- DTXSID20556791
- 110562-14-6
-
- Inchi： 1S/C18H30O5/c1-2-3-5-8-14-9-6-4-7-10-15(22-14)13-16(19)18(21)12-11-17(20)23-18/h14-15,21H,2-13H2,1H3
- InChI Key： XGFGONPCXDNIMO-UHFFFAOYSA-N
- SMILES： O1C(CC(C2(CCC(=O)O2)O)=O)CCCCCC1CCCCC
Computed Properties
- Exact Mass: 326.20932405g/mol
- Monoisotopic Mass: 326.20932405g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 7
- Complexity: 408
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 72.8?2
gloeosporone Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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