14-methyl-N-[2-methyl-4,5-bis(oxidanyl)-6-(7H-purin-6-ylamino)oxan-3-yl]pentadecanamide

Systemtic Name: 14-methyl-N-[2-methyl-4,5-bis(oxidanyl)-6-(7H-purin-6-ylamino)oxan-3-yl]pentadecanamide Openeye Name: N-[4,5-dihydroxy-2-methyl-6-(7H-purin-6-ylamino)tetrahydropyran-3-yl]-14-methyl-pentadecanamide CAS Name: N-[4,5-dihydroxy-2-methyl-6-(7H-purin-6-ylamino)-3-oxanyl]-14-methylpentadecanamide IUPAC Name: N-[4,5-dihydroxy-2-methyl-6-(7H-purin-6-ylamino)oxan-3-yl]-14-methylpentadecanamide Traditional Name: N-[4,5-dihydroxy-2-methyl-6-(7H-purin-6-ylamino)tetrahydropyran-3-yl]-14-methyl-pentadecanamide Formula: C27H46N6O4 MolecularWeight: 518.69194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)NC2=NC=NC3=C2NC=N3)O)O)NC(=O)CCCCCCCCCCCCC(C)C

Isomeric SMILES

CC1C(C(C(C(O1)NC2=NC=NC3=C2NC=N3)O)O)NC(=O)CCCCCCCCCCCCC(C)C

InChI

InChI=1S/C27H46N6O4/c1-18(2)14-12-10-8-6-4-5-7-9-11-13-15-20(34)32-21-19(3)37-27(24(36)23(21)35)33-26-22-25(29-16-28-22)30-17-31-26/h16-19,21,23-24,27,35-36H,4-15H2,1-3H3,(H,32,34)(H2,28,29,30,31,33)