Glycoside
GD049020
Name:
NoneFormula:
C11H17O7N3Smiles:
COCn1cc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)cn1Aglycone:
COCn1cc(N)cn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 8 |
| MolWt: | 303.27 | Num_heavy_atoms: | 21 |
| TPSA: | 154.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD26014
Formula: C5H9ON3
Smiles:
COCn1cc(N)cn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 127.15 | Num_heavy_atoms: | 9 |
| TPSA: | 53.07 | NumAromaticRings: | 1 |
