Glycoside
GD126841
Name:
PlumerubrosideFormula:
C24H30O12Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)c2c(c1)OC(c1cc(OC)c(O)c(OC)c1)C(O)C2Aglycone:
COc1cc(O)c2c(c1)OC(c1cc(OC)c(O)c(OC)c1)C(O)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 510.49 | Num_heavy_atoms: | 36 |
| TPSA: | 176.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD51343
Formula: C18H20O7
Smiles:
COc1cc(O)c2c(c1)OC(c1cc(OC)c(O)c(OC)c1)C(O)C2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.35 | Num_heavy_atoms: | 25 |
| TPSA: | 97.61 | NumAromaticRings: | 2 |
