Glycoside
GD114166
Name:
KoaburaninFormula:
C21H24O8Smiles:
OCC1OC(Oc2cc(O)c3c(c2)OC(c2ccccc2)CC3)C(O)C(O)C1OAglycone:
Oc1cc(O)c2c(c1)OC(c1ccccc1)CC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.42 | Num_heavy_atoms: | 29 |
| TPSA: | 128.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD44871
Formula: C15H14O3
Smiles:
Oc1cc(O)c2c(c1)OC(c1ccccc1)CC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 3.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.27 | Num_heavy_atoms: | 18 |
| TPSA: | 49.69 | NumAromaticRings: | 2 |
