Glycoside
GD142417
Name:
Kunzeaphlogin FFormula:
C24H36O14Smiles:
Cc1c(O)c(C(=O)C(C)C)c(OC2OC(CO)C(O)C(O)C2O)c(C)c1OC1OC(CO)C(O)C(O)C1OAglycone:
Cc1c(O)c(C)c(O)c(C(=O)C(C)C)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.71 |
| AlogP: | -2.79 | Num_rotatable_bonds: | 8 |
| MolWt: | 548.54 | Num_heavy_atoms: | 38 |
| TPSA: | 236.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD57314
Formula: C12H16O4
Smiles:
Cc1c(O)c(C)c(O)c(C(=O)C(C)C)c1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 224.26 | Num_heavy_atoms: | 16 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
