Glycoside
GD003266
Name:
NoneFormula:
C17H13O4N5ClISmiles:
O=C(Nc1nc(Cl)nc2c1ncn2[C@@H]1OC[C@H](O)[C@H]1O)c1cccc(I)c1Aglycone:
O=C(Nc1nc(Cl)nc2c1N=C[N]2)c1cccc(I)c1Sugarmoiety:
OC1COC(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 501.67 | Num_heavy_atoms: | 27 |
| TPSA: | 122.39 | NumAromaticRings: | 3 |
Unique Aglycone
AD02975
Formula: C13H6ON5ClI
Smiles:
O=C(Nc1nc(Cl)nc2c1N=C[N]2)c1cccc(I)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 398.57 | Num_heavy_atoms: | 20 |
| TPSA: | 81.34 | NumAromaticRings: | 2 |
