Glycoside
GD075871
Name:
NoneFormula:
C18H21O6N3Smiles:
Cc1cc2cc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@@H](O)[C@H](O)CO)c2cc1CAglycone:
Cc1cc2cc3c(=O)[nH]c(=O)nc-3n(C)c2cc1CSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 375.38 | Num_heavy_atoms: | 27 |
| TPSA: | 148.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD10558
Formula: C14H13O2N3
Smiles:
Cc1cc2cc3c(=O)[nH]c(=O)nc-3n(C)c2cc1C| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 0 |
| MolWt: | 255.28 | Num_heavy_atoms: | 19 |
| TPSA: | 67.75 | NumAromaticRings: | 1 |
