7C

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 4
Total Number of Articles : 3
PubChem 444045
Molecular Formula

C28H38N8O17P2

SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)OP(=O)(O)OC[C@@H]3[C@H](C[C@@H](O3)N4C=CC(=NC4=O)N)OP(=O)(O)OC[C@@H]5[C@H](C[C@@H](O5)N6C=CC(=NC6=O)N)O

InChI

InChI=1S/C28H38N8O17P2/c1-13-9-36(28(42)33-25(13)39)24-7-15(17(10-37)49-24)52-55(45,46)48-12-19-16(8-23(51-19)35-5-3-21(30)32-27(35)41)53-54(43,44)47-11-18-14(38)6-22(50-18)34-4-2-20(29)31-26(34)40/h2-5,9,14-19,22-24,37-38H,6-8,10-12H2,1H3,(H,43,44)(H,45,46)(H2,29,31,40)(H2,30,32,41)(H,33,39,42)/t14-,15-,16-,17+,18+,19+,22+,23+,24+/m0/s1

synonyms
  • 7C
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Properties
Property Value
MW 820.6 g/mol
HBD 7
HBA 17
Rotatable Bond Count 14
Exact Mass 820.18301577 g/mol
Monoisotopic Mass 820.18301577 g/mol
Heavy Atom Count 55
Isotope Atom Count 0
Atom Stereo Count 9
Covalent Unit Count 1
Complexity 1830
xlogp -6.1
Topological Polar Surface Area 346