Glycoside
GD091269
Name:
NoneFormula:
C14H19O6N2ISmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ncccc2I)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ncccc1ISugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 438.22 | Num_heavy_atoms: | 23 |
| TPSA: | 121.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD39802
Formula: C8H9O2N2I
Smiles:
O=C(NCCO)c1ncccc1I| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.08 | Num_heavy_atoms: | 13 |
| TPSA: | 62.22 | NumAromaticRings: | 1 |
