63-38-7 (胞苷-5-二磷酸二钠盐,Cytidine 5'-(trihydrogen diphosphate))

胞苷-5-二磷酸二钠盐(63-38-7)名称与标识符

名称

中文别名:
胞苷-5-二磷酸二钠盐;5-胞苷二磷酸二钠盐;胞苷-5’-二磷酸;胞苷-5'-二磷酸;胞苷5-双磷酸;5-胞嘧啶核苷二磷酸二钠盐;5'-二磷酸胞苷二钠;胞啶二磷胆碱二钠;胞磷胆碱二钠;胆碱胞嘧啶核甙二磷酸酯二钠盐;胆碱胞嘧啶核苷二磷酸酯二钠盐;胞苷 5'-(三氢焦磷酸酯);
英文别名:
Cytidine 5'-(trihydrogen diphosphate);CYTIDINE 5’-DIPHOSPHATE;[[5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxyphosphonic acid;[14C]-5'-CDP;5'-CDP;Citidine-5'-diphosphate;cytidine 5'-diphosphate;Cytidine 5'-pyrophosphate;Cytidine coenzyme;cytidine diphosphate;Cytidine, mono(trihydrogen diphosphate) (ester);CDP;5′-CDP,2Na;EINECS 200-557-1;CYTIDINE, 5'-(TRIHYDROGEN PYROPHOSPHATE);102601-46-7;Cytidine5'-(trihydrogendiphosphate);BDBM50194153;4-25-00-03675 (Beilstein Handbook Reference);689C62C2-5E68-4D32-9718-800937EE9942;SCHEMBL20609277;[3h]cytidine diphosphate;34393-59-4;Q416847;Cytidine 5'-(trihydrogen pyrophosphate) (8CI);[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid;DB04555;Sulbactum sodium;Cytidine 5 -diphosphate;Cytidine 5''-pyrophosphate;CYTIDINE 5-DIPHOSPHATE, PERIODATEOXIDIZ ED SODIUM;[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate;1ZH821MXU5;UNII-1ZH821MXU5;AS-11807;cytidine 5''-(trihydrogen diphosphate);cytidine-5'-diphosphate;Cytidine 5'-(trihydrogen pyrophosphate);SCHEMBL154172;((2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate;Cytidine 5''-diphosphoric acid;C16128;BRN 0063920;NS00070402;[[(2R,3S,4R,5R)-5-(4-Amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxyphosphonic acid;cytidine-diphosphate;bmse000272;C00112;Cytidine diphosphate sodium salt;DTXSID501014481;Cytidine, 5''-(trihydrogen pyrophosphate);Cytidine 5'-pyrophosphoric acid;Cytidine pyrophosphate;5''-CDP;Cytidine 5'-(trihydrogen diphosphate) (9CI);A834354;CHEMBL425252;CHEBI:17239;CYTIDINE 5/'-DIPHOSPHATE, PERIODATEOXIDIZ ED SODIUM;5 inverted exclamation marka-CDP pound not2Na;cytidine, 5'-(trihydrogen diphosphate);Cytidine-5 inverted exclamation marka-diphosphate;Cytidine 5'-diphosphoric acid;63-38-7;Cytidine 5'-(trihydrogen diphosphate-P-32P) (9CI);Cytidine pyrophosphate (6CI);54394-90-0;CDP Sodium Salt;AKOS016010110;CYTIDINE-5'-diphosphoric acid;disodium;((5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methoxy-oxido-phosphoryl) hydrogen phosphate;Cytidine-5'-(trihydrogen diphosphate);Diphosphate, Cytidine;DTXCID001437064;Cytidine diphosphoric acid;disodium;[[5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl] hydrogen phosphate;Cytidine, 5'-(trihydrogen pyrophosphoric acid);

标识符

MDL:
MFCD00066486
InChIKey:
ZWIADYZPOWUWEW-XVFCMESISA-N
Inchi:
1S/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
SMILES:
P(=O)(O)(OP(=O)(O)O)OC[C@@H]1[C@H]([C@H]([C@H](N2C(N=C(C=C2)N)=O)O1)O)O

胞苷-5-二磷酸二钠盐(63-38-7)物化性质

实验特性

  • LogP : -1.74780
  • PSA : 243.51000
  • 沸点 : 767.4°C at 760 mmHg
  • 熔点 : 183 ºC (分解)
  • 溶解度 : 易溶 (140 g/L) (25 ºC),
  • 密度 : 2.35±0.1 g/cm3 (20 ºC 760 Torr),

计算特性

  • 精确分子量 : 403.01800
  • 氢键供体数量 : 7
  • 氢键受体数量 : 14
  • 可旋转化学键数量 : 6
  • 同位素质量 : 403.01818230g/mol
  • 重原子数量 : 25
  • 复杂度 : 690
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 4
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : -4.5
  • 拓扑分子极性表面积 : 222Ų

胞苷-5-二磷酸二钠盐(63-38-7)国际标准相关数据

EINECS:
200-557-1

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