C-C-PPU
Molecular Formula:
C40H53N13O19P2
InChI: InChI=1/C40H53N13O19P2/c1-50(2)33-27-34(45-16-44-33)53(17-46-27)36-28(55)26(49-35(58)20(41)12-18-4-6-19(65-3)7-5-18)22(69-36)14-66-73(61,62)72-32-23(70-38(30(32)57)52-11-9-25(43)48-40(52)60)15-67-74(63,64)71-31-21(13-54)68-37(29(31)56)51-10-8-24(42)47-39(51)59/h4-11,16-17,20-23,26,28-32,36-38,54-57H,12-15,41H2,1-3H3,(H,49,58)(H,61,62)(H,63,64)(H2,42,47,59)(H2,43,48,60)/t20-,21+,22+,23+,26+,28+,29+,30+,31+,32+,36+,37+,38+/m0/s1/f/h49,61,63H,42-43H2
InChIKey: InChIKey=FDAQMEJPNDQXRF-VCRPRYNNDP
SMILES: CN(C)C1=NC=NC2=C1N=CN2C3C(C(C(O3)COP(=O)(O)OC4C(OC(C4O)N5C=CC(=NC5=O)N)COP(=O)(O)OC6C(OC(C6O)N7C=CC(=NC7=O)N)CO)NC(=O)C(CC8=CC=C(C=C8)OC)N)O
Names:
C-C-PPU
[(2R,3S,4R,5R)-3-[[(2S)-2-amino-3-(4-methoxyphenyl)propanoyl]amino]-5-(6-dimethylaminopurin-9-yl)-4-hydroxy-oxolan-2-yl]methoxy-[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2-[[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxy-phosphoryl]oxymethyl]-4-hydroxy-oxolan-3-yl]oxy-phosphinic acid
Registries:
PubChem CID 5326857
PubChem ID 8142662
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