Glycoside
GD141667
Name:
Junipercomnoside AFormula:
C24H30O10Smiles:
COc1cc(C2Oc3c(O)cc(CCCO)cc3C2CO)ccc1OC1OCC(O)C(O)C1OAglycone:
COc1cc(C2Oc3c(O)cc(CCCO)cc3C2CO)ccc1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 8 |
| MolWt: | 478.49 | Num_heavy_atoms: | 34 |
| TPSA: | 158.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD01816
Formula: C19H22O6
Smiles:
COc1cc(C2Oc3c(O)cc(CCCO)cc3C2CO)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 346.38 | Num_heavy_atoms: | 25 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
