Glycoside
GD016761
Name:
NoneFormula:
C24H25O11N3Smiles:
COC(=O)Nc1nc2cc(C(=O)c3ccccc3)ccc2n1COC(=O)OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)Nc1nc2cc(C(=O)c3ccccc3)ccc2n1COC(=O)OCSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 531.47 | Num_heavy_atoms: | 38 |
| TPSA: | 198.9 | NumAromaticRings: | 3 |
Unique Aglycone
AD12027
Formula: C19H17O6N3
Smiles:
COC(=O)Nc1nc2cc(C(=O)c3ccccc3)ccc2n1COC(=O)OC| HBA: | 9 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.16 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 383.36 | Num_heavy_atoms: | 28 |
| TPSA: | 108.75 | NumAromaticRings: | 3 |
