Glycoside
GD157004
Name:
Be 12406BFormula:
C24H22O9Smiles:
Cc1cc(O)c2c(c1)c(=O)oc1c3cccc(O)c3c(OC3OC(C)C(O)C(O)C3O)cc12Aglycone:
Cc1cc(O)c2c(c1)c(=O)oc1c3cccc(O)c3c(O)cc12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 2 |
| MolWt: | 454.43 | Num_heavy_atoms: | 33 |
| TPSA: | 149.82 | NumAromaticRings: | 4 |
Unique Aglycone
AD62116
Formula: C18H12O5
Smiles:
Cc1cc(O)c2c(c1)c(=O)oc1c3cccc(O)c3c(O)cc12| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 3.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 308.29 | Num_heavy_atoms: | 23 |
| TPSA: | 90.9 | NumAromaticRings: | 4 |
