Glycoside
GD147897
Name:
NoneFormula:
C32H33O10NSmiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(OC3OC(C)C(O)C(O)C3O)c(C3CCCC3)c(O)c1C2=OAglycone:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(C3CCCC3)c(O)c1C2=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 591.61 | Num_heavy_atoms: | 43 |
| TPSA: | 172.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD59210
Formula: C26H23O6N
Smiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(C3CCCC3)c(O)c1C2=O| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 4.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 445.47 | Num_heavy_atoms: | 33 |
| TPSA: | 113.26 | NumAromaticRings: | 2 |
