Glycoside
GD029081
Name:
NoneFormula:
C15H20O4N5ISmiles:
OC[C@@H]1OC(n2cnc3c(NC4CCCC4)nc(I)nc32)[C@H](O)[C@H]1OAglycone:
Ic1nc2c(c(NC3CCCC3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 461.26 | Num_heavy_atoms: | 25 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD18955
Formula: C10H11N5I
Smiles:
Ic1nc2c(c(NC3CCCC3)n1)N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 328.14 | Num_heavy_atoms: | 16 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
