Glycoside
GD037000
Name:
NoneFormula:
C29H39O7NSSmiles:
COC(=O)C(C)(C)NC(=O)CCCc1ccc(Cc2cc([C@@H]3O[C@H](SC)[C@H](O)[C@H](O)[C@H]3O)ccc2C)cc1Aglycone:
COC(=O)C(C)(C)NC(=O)CCCc1ccc(Cc2ccccc2C)cc1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 10 |
| MolWt: | 545.7 | Num_heavy_atoms: | 38 |
| TPSA: | 125.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD23336
Formula: C23H29O3N
Smiles:
COC(=O)C(C)(C)NC(=O)CCCc1ccc(Cc2ccccc2C)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.39 |
| AlogP: | 3.98 | Num_rotatable_bonds: | 8 |
| MolWt: | 367.49 | Num_heavy_atoms: | 27 |
| TPSA: | 55.4 | NumAromaticRings: | 2 |
