Glycoside
GD114270
Name:
NoneFormula:
C35H33O11NSmiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(OC3OC(C)C(O)C(O)C3O)c(Cc3cccc(CO)c3)c(O)c1C2=OAglycone:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(Cc3cccc(CO)c3)c(O)c1C2=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 8 |
| MolWt: | 643.65 | Num_heavy_atoms: | 47 |
| TPSA: | 192.41 | NumAromaticRings: | 3 |
Unique Aglycone
AD44947
Formula: C29H23O7N
Smiles:
CC(=O)Oc1ccc2c(c1)C(=O)c1c(CC3=CCN=C3)c(O)c(Cc3cccc(CO)c3)c(O)c1C2=O| HBA: | 8 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 3.43 | Num_rotatable_bonds: | 6 |
| MolWt: | 497.5 | Num_heavy_atoms: | 37 |
| TPSA: | 133.49 | NumAromaticRings: | 3 |
