Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LIQL20
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| Ligand Name |
5'-O-[(S)-{[(S)-{[(2R,3R,4S)-3,4-Dihydroxypyrrolidin-2-YL]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine
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| Synonyms |
5'-O-[(S)-{[(S)-{[(2R,3R,4S)-3,4-DIHYDROXYPYRROLIDIN-2-YL]METHOXY}(HYDROXY)PHOSPHORYL]OXY}(HYDROXY)PHOSPHORYL]ADENOSINE; CHEMBL1230692; CHEBI:40454; [(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl-ADP; adenosine 5'-diphosphate (hydroxymethyl)pyrrolidinediol; adenosine 5'-(3-{[(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl} dihydrogen diphosphate); A1R; ADP-HPD; ADP-(hydroxymethyl)pyrrolidinediol; BDBM50350107; [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl hydrogen phosphate; Q27120396; Adenosine 5'-diphosphoric acid beta-[(3beta,4beta-dihydroxypyrrolidin-2alpha-yl)methyl] ester
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| Structure |
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Download2D MOL |
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| Formula |
C15H24N6O12P2
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| Canonical SMILES |
C1C(C(C(N1)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/C15H24N6O12P2/c16-13-9-14(19-4-18-13)21(5-20-9)15-12(25)11(24)8(32-15)3-31-35(28,29)33-34(26,27)30-2-6-10(23)7(22)1-17-6/h4-8,10-12,15,17,22-25H,1-3H2,(H,26,27)(H,28,29)(H2,16,18,19)/t6-,7+,8-,10-,11-,12-,15-/m1/s1
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| InChIKey |
NDQDTBCXPOIQGT-UHNJQBFTSA-N
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| PubChem Compound ID | ||||
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