Cas no 78433-94-0 (CYTIDINE, 5-(1-PROPENYL)-)
CYTIDINE, 5-(1-PROPENYL)- structure
Product Name:CYTIDINE, 5-(1-PROPENYL)-
CAS No:78433-94-0
MF:C12H17N3O5
MW:283.280483007431
CID:3419667
PubChem ID:53764193
Update Time:2025-04-21
CYTIDINE, 5-(1-PROPENYL)- Chemical and Physical Properties
Names and Identifiers
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- CYTIDINE, 5-(1-PROPENYL)-
- DTXSID901312160
- 78433-94-0
- SCHEMBL11313272
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- Inchi： 1S/C12H17N3O5/c1-2-3-6-4-15(12(19)14-10(6)13)11-9(18)8(17)7(5-16)20-11/h2-4,7-9,11,16-18H,5H2,1H3,(H2,13,14,19)/t7-,8-,9-,11-/m1/s1
- InChI Key： DKBAGXPNBHVCTA-TURQNECASA-N
- SMILES： O1[C@H](CO)[C@H]([C@H]([C@@H]1N1C(N=C(C(C=CC)=C1)N)=O)O)O
Computed Properties
- Exact Mass: 283.11682065Da
- Monoisotopic Mass: 283.11682065Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 487
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: -1.4
- Topological Polar Surface Area: 129?2
CYTIDINE, 5-(1-PROPENYL)- Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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