9K9

2-amino-9-[(2S,3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxotetrahydro-2H-2lambda~5~-furo[3,4-d][1,3,2]dioxaphosphol-4-yl]-3,9-dihydro-6H-purin-6-one


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Chemical Component Summary

Name2-amino-9-[(2S,3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxotetrahydro-2H-2lambda~5~-furo[3,4-d][1,3,2]dioxaphosphol-4-yl]-3,9-dihydro-6H-purin-6-one
Identifiers9-[(3~{a}~{R},4~{R},6~{R},6~{a}~{R})-6-(hydroxymethyl)-2-oxidanyl-2-oxidanylidene-3~{a},4,6,6~{a}-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-2-azanyl-3~{H}-purin-6-one
FormulaC10 H12 N5 O7 P
Molecular Weight345.205
TypeNON-POLYMER
Isomeric SMILESc1nc2c(n1[C@H]3[C@H]4[C@@H]([C@H](O3)CO)OP(=O)(O4)O)NC(=NC2=O)N
InChIInChI=1S/C10H12N5O7P/c11-10-13-7-4(8(17)14-10)12-2-15(7)9-6-5(3(1-16)20-9)21-23(18,19)22-6/h2-3,5-6,9,16H,1H2,(H,18,19)(H3,11,13,14,17)/t3-,5-,6-,9-/m1/s1
InChIKeyUASRYODFRYWBRC-UUOKFMHZSA-N

Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count4
Bond Count38
Aromatic Bond Count5

Related Resource References

Resource NameReference
PubChem 5280908, 135398728, 92823
ChEBI CHEBI:28181