Glycoside
GD073311
Name:
NoneFormula:
C17H21O8N3Smiles:
COc1ccccc1[C@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c1nnc(C)o1Aglycone:
COc1ccccc1C(N)c1nnc(C)o1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 9 |
| MolWt: | 395.37 | Num_heavy_atoms: | 28 |
| TPSA: | 175.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD34014
Formula: C11H13O2N3
Smiles:
COc1ccccc1C(N)c1nnc(C)o1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 219.24 | Num_heavy_atoms: | 16 |
| TPSA: | 74.17 | NumAromaticRings: | 2 |
