Glycoside
GD033863
Name:
NoneFormula:
C33H38O10N4Smiles:
COc1ccc(C(=O)Nc2cccc(O[C@@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)c2NC(=O)c2ccc(N3CCCN(C)CC3)cc2)cc1Aglycone:
COc1ccc(C(=O)Nc2cccc(O)c2NC(=O)c2ccc(N3CCCN(C)CC3)cc2)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 9 |
| MolWt: | 650.68 | Num_heavy_atoms: | 47 |
| TPSA: | 190.36 | NumAromaticRings: | 3 |
Unique Aglycone
AD21587
Formula: C27H30O4N4
Smiles:
COc1ccc(C(=O)Nc2cccc(O)c2NC(=O)c2ccc(N3CCCN(C)CC3)cc2)cc1| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.26 |
| AlogP: | 4.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 474.56 | Num_heavy_atoms: | 35 |
| TPSA: | 94.14 | NumAromaticRings: | 3 |
