Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB3CK8
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| Ligand Name |
(2r,3r,4s,5r)-5-({[(R)-{[(R)-{[(2r,3s,4r,5r)-5-(6-Amino-9h-Purin-9-Yl)-3,4-Dihydroxytetrahydrofuran-2-Yl]methoxy}(Hydroxy)phosphoryl]oxy}(Hydroxy)phosphoryl]oxy}methyl)-3,4-Dihydroxytetrahydrofuran-2-Yl Acetate
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| Synonyms |
(2r,3r,4s,5r)-5-({[(R)-{[(R)-{[(2r,3s,4r,5r)-5-(6-Amino-9h-Purin-9-Yl)-3,4-Dihydroxytetrahydrofuran-2-Yl]methoxy}(Hydroxy)phosphoryl]oxy}(Hydroxy)phosphoryl]oxy}methyl)-3,4-Dihydroxytetrahydrofuran-2-Yl Acetate; ACETYL-RIBOSYL-ADP; Q27467661
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| Structure |
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Download2D MOL |
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| Formula |
C17H25N5O15P2
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| Canonical SMILES |
CC(=O)OC1C(C(C(O1)COP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)O)O)O
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| InChI |
1S/C17H25N5O15P2/c1-6(23)34-17-13(27)11(25)8(36-17)3-33-39(30,31)37-38(28,29)32-2-7-10(24)12(26)16(35-7)22-5-21-9-14(18)19-4-20-15(9)22/h4-5,7-8,10-13,16-17,24-27H,2-3H2,1H3,(H,28,29)(H,30,31)(H2,18,19,20)/t7-,8-,10-,11-,12-,13-,16-,17+/m1/s1
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| InChIKey |
IJOUKWCBVUMMCR-DLFWLGJNSA-N
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| PubChem Compound ID | ||||
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