Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE0U5F
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| Ligand Name |
[(2~{r},5~{s})-1-[(2~{r},3~{s},4~{r},5~{r})-5-(6-Aminopurin-9-Yl)-3,4-Bis(Oxidanyl)oxolan-2-Yl]-5-Azaniumyl-6-Oxidanyl-6-Oxidanylidene-Hexan-2-Yl]-(Phenylmethyl)azanium
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| Synonyms |
[(2~{r},5~{s})-1-[(2~{r},3~{s},4~{r},5~{r})-5-(6-Aminopurin-9-Yl)-3,4-Bis(Oxidanyl)oxolan-2-Yl]-5-Azaniumyl-6-Oxidanyl-6-Oxidanylidene-Hexan-2-Yl]-(Phenylmethyl)azanium; 76O
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| Structure |
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Download2D MOL |
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| Formula |
C22H31N7O5+2
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| Canonical SMILES |
C1=CC=C(C=C1)C[NH2+]C(CCC(C(=O)O)[NH3+])CC2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)O
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| InChI |
1S/C22H29N7O5/c23-14(22(32)33)7-6-13(25-9-12-4-2-1-3-5-12)8-15-17(30)18(31)21(34-15)29-11-28-16-19(24)26-10-27-20(16)29/h1-5,10-11,13-15,17-18,21,25,30-31H,6-9,23H2,(H,32,33)(H2,24,26,27)/p+2/t13-,14+,15-,17-,18-,21-/m1/s1
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| InChIKey |
FIOIMCLLFNYJFV-ZGTZEGHKSA-P
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| PubChem Compound ID | ||||
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