Glycoside
GD000452
Name:
Masutakeside IFormula:
C30H36O14Smiles:
COc1cc(CCCOC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)cc2cc(-c3ccc4c(c3)OCO4)oc12Aglycone:
COc1cc(CCCO)cc2cc(-c3ccc4c(c3)OCO4)oc12Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 10 |
| MolWt: | 620.6 | Num_heavy_atoms: | 44 |
| TPSA: | 199.13 | NumAromaticRings: | 3 |
Unique Aglycone
AD00502
Formula: C19H18O5
Smiles:
COc1cc(CCCO)cc2cc(-c3ccc4c(c3)OCO4)oc12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.26 |
| AlogP: | 3.76 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.35 | Num_heavy_atoms: | 24 |
| TPSA: | 61.06 | NumAromaticRings: | 3 |
