Glycoside
GD084722
Name:
NoneFormula:
C19H23O7N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(-c3ccc(=O)[nH]n3)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccc(-c2ccc(=O)[nH]n2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 6 |
| MolWt: | 405.41 | Num_heavy_atoms: | 29 |
| TPSA: | 154.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD37876
Formula: C13H13O3N3
Smiles:
O=C(NCCO)c1ccc(-c2ccc(=O)[nH]n2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 259.26 | Num_heavy_atoms: | 19 |
| TPSA: | 95.08 | NumAromaticRings: | 2 |
