Cas no 197565-90-5 (Calystegine A7)
Calystegine A7 structure
Product Name:Calystegine A7
CAS No:197565-90-5
MF:C7H13NO3
MW:159.183022260666
CID:2087191
PubChem ID:25107528
Update Time:2025-04-21
Calystegine A7 Chemical and Physical Properties
Names and Identifiers
-
- Calystegine A7
- 197565-90-5
- DTXSID801223312
- (1R,2S,4S,5R)-8-azabicyclo[3.2.1]octane-1,2,4-triol
- 8-Azabicyclo(3.2.1)octane-1,2,4-triol, (1R,2S,4S,5R)-
- (-)-Calystegine A7
- CHEBI:173215
- AKOS040735431
-
- Inchi： 1S/C7H13NO3/c9-5-3-6(10)7(11)2-1-4(5)8-7/h4-6,8-11H,1-3H2
- InChI Key： FSMRMYVITPBGGD-UHFFFAOYSA-N
- SMILES： OC1C2NC(CC2)(O)C(O)C1
Computed Properties
- Exact Mass: 159.08954328Da
- Monoisotopic Mass: 159.08954328Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 175
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.083
- Topological Polar Surface Area: 72.7?2
Experimental Properties
- Color/Form: Powder
Calystegine A7 Related Literature
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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