Glycoside
GD000410
Name:
NoneFormula:
C24H26O12Smiles:
COc1cc(O)c2c(=O)cc(C3(OC(C)=O)C=CC(OC4OC(CO)C(O)C(O)C4O)C=C3)oc2c1Aglycone:
COc1cc(O)c2c(=O)cc(C3(OC(C)=O)C=CC(O)C=C3)oc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 506.46 | Num_heavy_atoms: | 36 |
| TPSA: | 185.35 | NumAromaticRings: | 2 |
Unique Aglycone
AD00460
Formula: C18H16O7
Smiles:
COc1cc(O)c2c(=O)cc(C3(OC(C)=O)C=CC(O)C=C3)oc2c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 344.32 | Num_heavy_atoms: | 25 |
| TPSA: | 106.2 | NumAromaticRings: | 2 |
