Glycoside
GD095420
Name:
NoneFormula:
C15H19O7N4ISmiles:
COC(=O)[C@@H](O)CNc1ncnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COC(=O)C(O)CNc1ncnc2c1C(I)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.24 | Num_heavy_atoms: | 27 |
| TPSA: | 159.19 | NumAromaticRings: | 2 |
Unique Aglycone
AD40733
Formula: C10H10O3N4I
Smiles:
COC(=O)C(O)CNc1ncnc2c1C(I)=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.12 | Num_heavy_atoms: | 18 |
| TPSA: | 98.44 | NumAromaticRings: | 1 |
