123402-21-1
9-[3-DEOXY-3-C-FLUORO-BETA-D-RIBOFURANOSYL]GUANINE
Name9-[3-DEOXY-3-C-FLUORO-BETA-D-RIBOFURANOSYL]GUANINE
1Identification
【Name】
9-[3-DEOXY-3-C-FLUORO-BETA-D-RIBOFURANOSYL]GUANINE
【CAS】
【MDL】
MFCD09263707
【English Synonyms】
【Formula】
C10 H12 F N5 O4
【MolWeight】
285.234
【Inchi】
InChI=1S/C10H12FN5O4/c11-4-3(1-17)20-9(6(4)18)16-2-13-5-7(16)14-10(12)15-8(5)19/h2-4,6,9,17-18H,1H2,(H3,12,14,15,19)/t3-,4-,6-,9-/m1/s1
【InChIKey】
InChIKey=VDOWHLFGBWKXJC-DXTOWSMRSA-N
【SMILES】
c1nc2c(=O)[nH]c(nc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)F)O)N
【MOL File】
9-[3-DEOXY-3-C-FLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:9
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
9-[3-DEOXY-3-C-FLUORO-BETA-D-RIBOFURANOSYL]GUANINE.cml