Glycoside
GD011053
Name:
NoneFormula:
C13H15O4N2ISmiles:
Cc1ccnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Cc1ccnc2c1C(I)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 390.18 | Num_heavy_atoms: | 20 |
| TPSA: | 87.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD08474
Formula: C8H6N2I
Smiles:
Cc1ccnc2c1C(I)=C[N]2| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 0 |
| MolWt: | 257.05 | Num_heavy_atoms: | 11 |
| TPSA: | 26.99 | NumAromaticRings: | 1 |
