Glycoside
GD084567
Name:
NoneFormula:
C21H24O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ncccc2C(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(c1ccccc1)c1cccnc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 7 |
| MolWt: | 416.43 | Num_heavy_atoms: | 30 |
| TPSA: | 138.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD37788
Formula: C15H14O3N2
Smiles:
O=C(c1ccccc1)c1cccnc1C(=O)NCCO| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 270.29 | Num_heavy_atoms: | 20 |
| TPSA: | 79.29 | NumAromaticRings: | 2 |
