Glycoside
GD054707
Name:
NoneFormula:
C12H17O8N3Smiles:
COC(=O)Cn1cc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)cn1Aglycone:
COC(=O)Cn1cc(N)cn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -3.36 | Num_rotatable_bonds: | 8 |
| MolWt: | 331.28 | Num_heavy_atoms: | 23 |
| TPSA: | 171.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD27874
Formula: C6H9O2N3
Smiles:
COC(=O)Cn1cc(N)cn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 155.16 | Num_heavy_atoms: | 11 |
| TPSA: | 70.14 | NumAromaticRings: | 1 |
