[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-[[(2R,3S,4R,5R)-5-(6-dimethylaminopurin-9-yl)-4-hydroxy-3-[[(2S)-2-hydroxy-3-phenyl-propanoyl]amino]oxolan-2-yl]methoxy]phosphinic acid
Molecular Formula:
C30H38N9O12P
InChI: InChI=1/C30H38N9O12P/c1-37(2)25-21-26(33-13-32-25)39(14-34-21)28-22(42)20(36-27(44)16(41)10-15-6-4-3-5-7-15)18(50-28)12-48-52(46,47)51-24-17(11-40)49-29(23(24)43)38-9-8-19(31)35-30(38)45/h3-9,13-14,16-18,20,22-24,28-29,40-43H,10-12H2,1-2H3,(H,36,44)(H,46,47)(H2,31,35,45)/t16-,17+,18+,20+,22+,23+,24+,28+,29+/m0/s1/f/h36,46H,31H2
InChIKey: InChIKey=PLQGVKZIHNIZTF-XBJVWJDIDV
SMILES: CN(C)C1=NC=NC2=C1N=CN2C3C(C(C(O3)COP(=O)(O)OC4C(OC(C4O)N5C=CC(=NC5=O)N)CO)NC(=O)C(CC6=CC=CC=C6)O)O
Names:
[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-[[(2R,3S,4R,5R)-5-(6-dimethylaminopurin-9-yl)-4-hydroxy-3-[[(2S)-2-hydroxy-3-phenyl-propanoyl]amino]oxolan-2-yl]methoxy]phosphinic acid
Registries:
PubChem CID 5326853
PubChem ID 11571316
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