Glycoside
GD036339
Name:
NoneFormula:
C38H55O8N3Smiles:
Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)N2CCN(C)CC2)ccc1Cc1cc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(O)cc1C(C)CAglycone:
Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)N2CCN(C)CC2)ccc1Cc1ccc(O)cc1C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 10 |
| MolWt: | 681.87 | Num_heavy_atoms: | 49 |
| TPSA: | 163.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD22927
Formula: C32H45O3N3
Smiles:
Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)N2CCN(C)CC2)ccc1Cc1ccc(O)cc1C(C)C| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 5.12 | Num_rotatable_bonds: | 8 |
| MolWt: | 519.73 | Num_heavy_atoms: | 38 |
| TPSA: | 72.88 | NumAromaticRings: | 2 |
