N-Acetyl-N6,O-didemethylpuromycin-5'-phosphate

Molecular Formula: C₂₂H₂₈N₇O₉P

InChI: InChI=1/C22H28N7O9P/c1-11(30)27-14(7-12-3-5-13(31)6-4-12)21(33)28-16-15(8-37-39(34,35)36)38-22(18(16)32)29-10-26-17-19(23-2)24-9-25-20(17)29/h3-6,9-10,14-16,18,22,31-32H,7-8H2,1-2H3,(H,27,30)(H,28,33)(H,23,24,25)(H2,34,35,36)/t14u,15-,16?,18-,22-/m1/s1/f/h23,27-28,34-35H

InChIKey: InChIKey=SBVCMDTYCKPOOK-CRWWWGFJDA
SMILES: CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC2C(OC(C2O)N3C=NC4=C3N=CN=C4NC)COP(=O)(O)O

Names:
    C07029
    N-Acetyl-N6,O-didemethylpuromycin-5'-phosphate
    [(2R,4R,5R)-3-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-4-hydroxy-5-(6-methylaminopurin-9-yl)oxolan-2-yl]methoxyphosphonic acid

Registries:
    PubChem CID 441217
    PubChem ID 9241