Glycoside
GD065648
Name:
NoneFormula:
C16H21O6N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cccc3nccn23)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cccc2nccn12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 351.36 | Num_heavy_atoms: | 25 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD31588
Formula: C10H11O2N3
Smiles:
O=C(NCCO)c1cccc2nccn12| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 205.22 | Num_heavy_atoms: | 15 |
| TPSA: | 66.63 | NumAromaticRings: | 2 |
