Glycoside
GD144969
Name:
Macrophylloside B (Hydrangea)Formula:
C23H26O11Smiles:
COc1cc(C2Cc3cccc(OC4OC(CO)C(O)C(O)C4O)c3C(=O)O2)cc(OC)c1OAglycone:
COc1cc(C2Cc3cccc(O)c3C(=O)O2)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 478.45 | Num_heavy_atoms: | 34 |
| TPSA: | 164.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD45701
Formula: C17H16O6
Smiles:
COc1cc(C2Cc3cccc(O)c3C(=O)O2)cc(OC)c1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.31 | Num_heavy_atoms: | 23 |
| TPSA: | 85.22 | NumAromaticRings: | 2 |
