Cas no 1114474-92-8 ((-)-kopsiyunnanine D)
(-)-kopsiyunnanine D structure
Product Name:(-)-kopsiyunnanine D
CAS No:1114474-92-8
MF:C21H30N2O
MW:326.475705623627
CID:2034443
PubChem ID:25243455
Update Time:2025-04-21
(-)-kopsiyunnanine D Chemical and Physical Properties
Names and Identifiers
-
- (-)-kopsiyunnanine D
- kopsiyunnanine D
- 1114474-92-8
- (15R)-15-ethyl-11-(methoxymethyl)-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene
- CHEMBL564146
- (15R)-15-ethyl-11-(methoxymethyl)-1,11-diazatetracyclo(13.3.1.04,12.05,10)nonadeca-4(12),5,7,9-tetraene
-
- Inchi： 1S/C21H30N2O/c1-3-21-11-6-13-22(15-21)14-10-18-17-7-4-5-8-19(17)23(16-24-2)20(18)9-12-21/h4-5,7-8H,3,6,9-16H2,1-2H3
- InChI Key： BTMSPIIXHRUNDY-UHFFFAOYSA-N
- SMILES： C1C=CC=C2C=1C1CCN3CCCC(CC)(C3)CCC=1N2COC
Computed Properties
- Exact Mass: 326.235813585Da
- Monoisotopic Mass: 326.235813585Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 428
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.454
- Topological Polar Surface Area: 17.4?2
(-)-kopsiyunnanine D Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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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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