Glycoside
GD010443
Name:
NoneFormula:
C30H36O10N2Smiles:
CCc1cc2c(cc1C(C)O)CC(NC[C@H](O)c1ccc(O[C@@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)c3[nH]c(=O)ccc13)C2Aglycone:
CCc1cc2c(cc1C(C)O)CC(NCC(O)c1ccc(O)c3[nH]c(=O)ccc13)C2Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.47 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 9 |
| MolWt: | 584.62 | Num_heavy_atoms: | 42 |
| TPSA: | 201.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD08059
Formula: C24H28O4N2
Smiles:
CCc1cc2c(cc1C(C)O)CC(NCC(O)c1ccc(O)c3[nH]c(=O)ccc13)C2| HBA: | 6 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.5 | Num_heavy_atoms: | 30 |
| TPSA: | 105.58 | NumAromaticRings: | 3 |
