Glycoside
GD034974
Name:
NoneFormula:
C27H30O14Smiles:
C[C@@H]1O[C@H](OC[C@@H]2O[C@H](O)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1Oc1c(-c2ccc(O)c(O)c2)oc2ccccc2c1=OAglycone:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2ccccc12Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.44 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 578.52 | Num_heavy_atoms: | 41 |
| TPSA: | 228.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD22168
Formula: C15H10O5
Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2ccccc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.24 | Num_heavy_atoms: | 20 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
