Glycoside
GD117305
Name:
termisoflavone aFormula:
C26H28O13Smiles:
COC1C(O)C(O)OC(Oc2ccc(-c3coc4cc(OC5CC(O)C(O)CO5)cc(O)c4c3=O)cc2)C1OAglycone:
O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12Sugarmoiety:
COC1C(O)C(O)OC(O)C1O.OC1CC(O)C(O)CO1Other Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 6 |
| MolWt: | 548.5 | Num_heavy_atoms: | 39 |
| TPSA: | 197.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD02603
Formula: C15H10O5
Smiles:
O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12| 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 |
