Cas no 130036-23-6 (Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester (9CI))
130036-23-6 structure
Product Name:Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester (9CI)
CAS No:130036-23-6
MF:C11H20N4O9P2
MW:414.24542427063
CID:152328
PubChem ID:122707
Update Time:2025-04-19
Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester (9CI) Chemical and Physical Properties
Names and Identifiers
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- Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester (9CI)
- 2',3'-dideoxycytidine diphosphoethanolamine
- 2',3'-Dideoxycytidine 5'-(trihydrogen diphosphate) P'-(2-aminoethyl) ester
- 2-aminoethyl [(2S,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl dihydrogen diphosphate
- 2-aminoethyl [5-(4-amino-2-oxopyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl dihydrogen diphosphate
- Cytidine 5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester
- Ddcdp ethanolamine
- 130036-23-6
- [2-aminoethoxy(hydroxy)phosphoryl] [5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methyl hydrogen phosphate
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- Inchi： 1S/C11H20N4O9P2/c12-4-6-21-25(17,18)24-26(19,20)22-7-8-1-2-10(23-8)15-5-3-9(13)14-11(15)16/h3,5,8,10H,1-2,4,6-7,12H2,(H,17,18)(H,19,20)(H2,13,14,16)
- InChI Key： GBUOFJVOGQHJIM-UHFFFAOYSA-N
- SMILES： P(=O)(O)(OP(=O)(O)OCCN)OCC1CCC(N2C(N=C(C=C2)N)=O)O1
Computed Properties
- Exact Mass: 414.070551
- Monoisotopic Mass: 414.070551
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 26
- Rotatable Bond Count: 9
- Complexity: 685
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _7.1
- Topological Polar Surface Area: 196
Experimental Properties
- Density: 1.92
- Boiling Point: 639.2°Cat760mmHg
- Flash Point: 340.3°C
- Refractive Index: 1.693
Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester (9CI) Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
130036-23-6 (Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-(2-aminoethyl) ester (9CI)) Related Products
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