Glycoside
GD135944
Name:
2-{[5-hydroxy-11-(4-hydroxyphenyl)-10,13-dimethoxy-8-oxatricyclo[7.4.0.0²,â·]trideca-1(13),2,4,6,9,11-hexaen-4-yl]oxy}-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C25H24O10Smiles:
COc1c(-c2ccc(O)cc2)cc(OC)c2c1oc1cc(O)c(OC3OC(CO)C(O)C3O)cc12Aglycone:
COc1c(-c2ccc(O)cc2)cc(OC)c2c1oc1cc(O)c(O)cc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | 2.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 484.46 | Num_heavy_atoms: | 35 |
| TPSA: | 151.21 | NumAromaticRings: | 4 |
Unique Aglycone
AD54955
Formula: C20H16O6
Smiles:
COc1c(-c2ccc(O)cc2)cc(OC)c2c1oc1cc(O)c(O)cc12| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | 4.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 352.34 | Num_heavy_atoms: | 26 |
| TPSA: | 92.29 | NumAromaticRings: | 4 |
