Glycoside
GD104023
Name:
NoneFormula:
C26H35O7NSmiles:
CC(=O)N[C@@H]1[C@H](Oc2ccc3c(c2)CC[C@@H]2[C@@H]3CC[C@]3(C)C(=O)CC[C@H]23)O[C@H](CO)[C@H](O)[C@@H]1OAglycone:
CC12CCC3c4ccc(O)cc4CCC3C1CCC2=OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 473.57 | Num_heavy_atoms: | 34 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD18025
Formula: C18H22O2
Smiles:
CC12CCC3c4ccc(O)cc4CCC3C1CCC2=O| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.61 |
| AlogP: | 3.82 | Num_rotatable_bonds: | 0 |
| MolWt: | 270.37 | Num_heavy_atoms: | 20 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
