Glycoside
GD017711
Name:
NoneFormula:
C24H29O10NSmiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=OAglycone:
CC(C)=CCC(O)C1=CC(=O)c2c(O)ccc(O)c2C1=OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 7 |
| MolWt: | 491.49 | Num_heavy_atoms: | 35 |
| TPSA: | 182.85 | NumAromaticRings: | 1 |
Unique Aglycone
AD02790
Formula: C16H16O5
Smiles:
CC(C)=CCC(O)C1=CC(=O)c2c(O)ccc(O)c2C1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.3 | Num_heavy_atoms: | 21 |
| TPSA: | 94.83 | NumAromaticRings: | 1 |
