Glycoside
GD048247
Name:
NoneFormula:
C13H21O6N3Smiles:
Cc1cc(C)n(CCNC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)n1Aglycone:
Cc1cc(C)n(CCN)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -2.74 | Num_rotatable_bonds: | 8 |
| MolWt: | 315.33 | Num_heavy_atoms: | 22 |
| TPSA: | 144.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD25842
Formula: C7H13N3
Smiles:
Cc1cc(C)n(CCN)n1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 139.2 | Num_heavy_atoms: | 10 |
| TPSA: | 43.84 | NumAromaticRings: | 1 |
