Cas no 146425-23-2 (Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen [(2S)-2-pyrrolidinylcarbonyl]phosphoramidate](9CI))
![Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen [(2S)-2-pyrrolidinylcarbonyl]phosphoramidate](9CI) structure](https://ossimg.kuujia.com/scimg/146500/146425-23-2x500.png)
146425-23-2 structure
Product Name:Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen [(2S)-2-pyrrolidinylcarbonyl]phosphoramidate](9CI)
CAS No:146425-23-2
MF:C15H22N7O8P
MW:459.351043224335
CID:187858
Update Time:2024-03-01
Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen [(2S)-2-pyrrolidinylcarbonyl]phosphoramidate](9CI) Chemical and Physical Properties
Names and Identifiers
-
- Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen [(2S)-2-pyrrolidinylcarbonyl]phosphoramidate](9CI)
- Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen (2-pyrrolidinylcarbonyl)phosphoramidate],(S)-
- Phosmidosine B
- Adenosine, 7,8-dihydro-8-oxo-, 5'-[hydrogen N-[(2S)-2-pyrrolidinylcarbonyl]phosphoramidate]
-
- Inchi： 1S/C15H22N7O8P/c16-11-8-12(19-5-18-11)22(15(26)20-8)14-10(24)9(23)7(30-14)4-29-31(27,28)21-13(25)6-2-1-3-17-6/h5-7,9-10,14,17,23-24H,1-4H2,(H,20,26)(H2,16,18,19)(H2,21,25,27,28)/t6-,7+,9+,10+,14+/m0/s1
- InChI Key： SEHSCEYJWJDMSC-XLZJSAHRSA-N
- SMILES： C(OP(NC([C@@H]1CCCN1)=O)(O)=O)[C@H]1O[C@@H](N2C3C(=C(N=CN=3)N)NC2=O)[C@H](O)[C@@H]1O
Computed Properties
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 15
- Heavy Atom Count: 31
- XLogP3: -4.94
Adenosine,7,8-dihydro-8-oxo-, 5'-[hydrogen [(2S)-2-pyrrolidinylcarbonyl]phosphoramidate](9CI) Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
Related Categories
- Solvents and Organic Chemicals Organic Compounds Nucleosides, nucleotides, and analogues Purine nucleotides Purine ribonucleoside monophosphates
- Solvents and Organic Chemicals Organic Compounds Nucleosides, nucleotides, and analogues Purine nucleotides Purine ribonucleotides Purine ribonucleoside monophosphates
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