Glycoside
GD035532
Name:
NoneFormula:
C37H55O8N3Smiles:
Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)NCC(C)(C)N)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)NCC(C)(C)N)ccc1Cc1ccc(O)cc1C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.57 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 12 |
| MolWt: | 669.86 | Num_heavy_atoms: | 48 |
| TPSA: | 194.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD22474
Formula: C31H45O3N3
Smiles:
Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)NCC(C)(C)N)ccc1Cc1ccc(O)cc1C(C)C| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 5.2 | Num_rotatable_bonds: | 10 |
| MolWt: | 507.72 | Num_heavy_atoms: | 37 |
| TPSA: | 104.45 | NumAromaticRings: | 2 |
