Cas no 150518-46-0 (Guanosine5'-(trihydrogen diphosphate), 8-azido-, P'-a-D-mannopyranosyl ester (9CI))
150518-46-0 structure
Product Name:Guanosine5'-(trihydrogen diphosphate), 8-azido-, P'-a-D-mannopyranosyl ester (9CI)
CAS No:150518-46-0
MF:C16H26N8O17P2
MW:664.36856508255
CID:161960
PubChem ID:156025107
Update Time:2025-04-19
Guanosine5'-(trihydrogen diphosphate), 8-azido-, P'-a-D-mannopyranosyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Guanosine5'-(trihydrogen diphosphate), 8-azido-, P'-a-D-mannopyranosyl ester (9CI)
- 8-Azido-gdp-mannose
- 8-Azidoguanosine diphosphate-mannose
- Guanosine 5'-(trihydrogen diphosphate), 8-azido-, P'-alpha-D-mannopyranosyl ester
- 150518-46-0
-
- Inchi： 1S/C10H14N8O11P2.C6H12O6/c11-9-14-6-3(7(21)15-9)13-10(16-17-12)18(6)8-5(20)4(19)2(28-8)1-27-31(25,26)29-30(22,23)24;7-1-2-3(8)4(9)5(10)6(11)12-2/h2,4-5,8,19-20H,1H2,(H,25,26)(H2,22,23,24)(H3,11,14,15,21);2-11H,1H2/t2-,4-,5-,8-;2-,3-,4+,5+,6?/m11/s1
- InChI Key： UQOWKXRPUHQJDD-OTODGYFASA-N
- SMILES： P(=O)(O)(OP(=O)(O)O)OC[C@@H]1[C@H]([C@H]([C@H](N2C(N=[N+]=[N-])=NC3C(NC(N)=NC2=3)=O)O1)O)O.O1C([C@H]([C@H]([C@@H]([C@H]1CO)O)O)O)O
Computed Properties
- Exact Mass: 664.08928
- Monoisotopic Mass: 664.08911539g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 12
- Hydrogen Bond Acceptor Count: 21
- Heavy Atom Count: 43
- Rotatable Bond Count: 8
- Complexity: 1060
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 8
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 373?2
Experimental Properties
- PSA: 415.26
Guanosine5'-(trihydrogen diphosphate), 8-azido-, P'-a-D-mannopyranosyl ester (9CI) Related Literature
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Wenjie Zhao,Hua Hou,Yuchun Jin,Zhixiang Zeng,Xuedong Wu,Qunji Xue RSC Adv., 2014,4, 60307-60315
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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