[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-oxidanyl-phosphoryl]boron

Systemtic Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-oxidanyl-phosphoryl]boron Openeye Name: [[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-hydroxy-phosphoryl]boron CAS Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-hydroxyphosphoryl]boron IUPAC Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-hydroxyphosphoryl]boron Traditional Name: [[(1R)-2-adenin-9-yl-1-methyl-ethoxy]methyl-hydroxy-phosphoryl]boron Formula: C9H13BN5O3P MolecularWeight: 281.015981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B]P(=O)(COC(C)CN1C=NC2=C1N=CN=C2N)O

Isomeric SMILES

[B]P(=O)(CO[C@H](C)CN1C=NC2=C1N=CN=C2N)O

InChI

InChI=1S/C9H13BN5O3P/c1-6(18-5-19(10,16)17)2-15-4-14-7-8(11)12-3-13-9(7)15/h3-4,6H,2,5H2,1H3,(H,16,17)(H2,11,12,13)/t6-/m1/s1