Glycoside
GD156728
Name:
NoneFormula:
C22H24O14Smiles:
COc1cc(C2=C(OC3OC(OO)C(O)C(O)C3O)C(=O)[C-]3C(O)=CC([OH2+])=CC3O2)cc(OC)c1OAglycone:
COc1cc(C2=C(O)C(=O)[C-]3C(O)=CC([OH2+])=CC3O2)cc(OC)c1OSugarmoiety:
OOC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.36 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 512.42 | Num_heavy_atoms: | 36 |
| TPSA: | 216.73 | NumAromaticRings: | 1 |
Unique Aglycone
AD62031
Formula: C17H16O8
Smiles:
COc1cc(C2=C(O)C(=O)[C-]3C(O)=CC([OH2+])=CC3O2)cc(OC)c1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.18 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.31 | Num_heavy_atoms: | 25 |
| TPSA: | 128.35 | NumAromaticRings: | 1 |
