Glycoside
GD124896
Name:
NoneFormula:
C36H35O10NSmiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(OC3OC(C)C(O)C(O)C3O)c(CCCc3ccccc3)c(O)c1C2=OAglycone:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(CCCc3ccccc3)c(O)c1C2=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 641.67 | Num_heavy_atoms: | 47 |
| TPSA: | 172.18 | NumAromaticRings: | 3 |
Unique Aglycone
AD50490
Formula: C30H25O6N
Smiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(CCCc3ccccc3)c(O)c1C2=O| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 4.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 495.53 | Num_heavy_atoms: | 37 |
| TPSA: | 113.26 | NumAromaticRings: | 3 |
