Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LCZ7W2
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| Ligand Name |
2'-Deoxy-5'-O-[(S)-{difluoro[(S)-Hydroxy(Phosphonooxy)phosphoryl]methyl}(Hydroxy)phosphoryl]adenosine
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| Synonyms |
2'-Deoxy-5'-O-[(S)-{difluoro[(S)-Hydroxy(Phosphonooxy)phosphoryl]methyl}(Hydroxy)phosphoryl]adenosine; Q27460139; 2'-Deoxyadenosine 5'-[[hydroxy(phosphonooxy)phosphinyl]difluoromethyl]phosphonic acid; F3A
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| Structure |
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Download2D MOL |
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| Formula |
C11H16F2N5O11P3
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| Canonical SMILES |
C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=O)(C(F)(F)P(=O)(O)OP(=O)(O)O)O)O
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| InChI |
1S/C11H16F2N5O11P3/c12-11(13,31(22,23)29-32(24,25)26)30(20,21)27-2-6-5(19)1-7(28-6)18-4-17-8-9(14)15-3-16-10(8)18/h3-7,19H,1-2H2,(H,20,21)(H,22,23)(H2,14,15,16)(H2,24,25,26)/t5-,6+,7+/m0/s1
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| InChIKey |
SRDWTQAPDNVDMA-RRKCRQDMSA-N
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| PubChem Compound ID | ||||
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