Glycoside
GD023244
Name:
NoneFormula:
C14H19O5N6ISmiles:
OC[C@@H]1OC(n2cnc3c(NN4CCOCC4)nc(I)nc32)[C@H](O)[C@H]1OAglycone:
Ic1nc2c(c(NN3CCOCC3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 478.25 | Num_heavy_atoms: | 26 |
| TPSA: | 138.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD15655
Formula: C9H10ON6I
Smiles:
Ic1nc2c(c(NN3CCOCC3)n1)N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 2 |
| MolWt: | 345.12 | Num_heavy_atoms: | 17 |
| TPSA: | 76.74 | NumAromaticRings: | 1 |
