Glycoside
GD035426
Name:
NoneFormula:
C22H32O7N4Smiles:
CC(C)c1[nH]nc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(NC(=O)CCN)cc1Aglycone:
CC(C)c1[nH]nc(O)c1Cc1ccc(NC(=O)CCN)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.55 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 9 |
| MolWt: | 464.52 | Num_heavy_atoms: | 33 |
| TPSA: | 183.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD22412
Formula: C16H22O2N4
Smiles:
CC(C)c1[nH]nc(O)c1Cc1ccc(NC(=O)CCN)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 302.38 | Num_heavy_atoms: | 22 |
| TPSA: | 104.03 | NumAromaticRings: | 2 |
