Cas no 63879-67-4 (Linaride)
Linaride structure
Product Name:Linaride
CAS No:63879-67-4
MF:C15H22O8
MW:330.330385684967
CID:512515
Update Time:2024-03-01
Linaride Chemical and Physical Properties
Names and Identifiers
-
- b-D-Glucopyranoside,(1S,4aR,5S,7aS)-1,4a,5,7a-tetrahydro-5-hydroxy-7-methylcyclopenta[c]pyran-1-yl
- b-D-Glucopyranoside,1,4a,5,7a-tetrahydro-5-hydroxy-7-methylcyclopenta[c]pyran-1-yl, [1S-(1a,4aa,5a,7aa)]-
- Linaride
-
- Inchi: 1S/C15H22O8/c1-6-4-8(17)7-2-3-21-14(10(6)7)23-15-13(20)12(19)11(18)9(5-16)22-15/h2-4,7-20H,5H2,1H3/t7-,8+,9+,10+,11+,12-,13+,14-,15-/m0/s1
- InChI Key: HPPZDIWRKXHSGN-FKVJWERZSA-N
- SMILES: O([C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)[C@H]1[C@@H]2C(C)=C[C@H]([C@@H]2C=CO1)O
Computed Properties
- Exact Mass: 330.131
- Monoisotopic Mass: 330.131
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 23
- Rotatable Bond Count: 3
- Complexity: 492
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 9
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 129
- XLogP3: -1.142
Linaride Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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C. Achilli,G. F. Guidetti,A. Ciana,D. Capsoni,G. Minetti Biomater. Sci., 2016,4, 1417-1421
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