Glycoside
GD121414
Name:
NoneFormula:
C33H35O10NSmiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(OC3OC(C)C(O)C(O)C3O)c(C3CCCCC3)c(O)c1C2=OAglycone:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(C3CCCCC3)c(O)c1C2=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 6 |
| MolWt: | 605.64 | Num_heavy_atoms: | 44 |
| TPSA: | 172.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD48870
Formula: C27H25O6N
Smiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(C3CCCCC3)c(O)c1C2=O| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 459.5 | Num_heavy_atoms: | 34 |
| TPSA: | 113.26 | NumAromaticRings: | 2 |
