Glycoside
GD022318
Name:
NoneFormula:
C24H26O13Smiles:
COc1c(-c2ccc(O)c(O)c2)oc2cc(OCCOC[C@@H]3OC(O)[C@H](O)[C@H](O)[C@H]3O)cc(O)c2c1=OAglycone:
COCCOc1cc(O)c2c(=O)c(OC)c(-c3ccc(O)c(O)c3)oc2c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 8 |
| MolWt: | 522.46 | Num_heavy_atoms: | 37 |
| TPSA: | 208.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD15147
Formula: C19H18O8
Smiles:
COCCOc1cc(O)c2c(=O)c(OC)c(-c3ccc(O)c(O)c3)oc2c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.21 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 374.35 | Num_heavy_atoms: | 27 |
| TPSA: | 118.59 | NumAromaticRings: | 3 |
