Glycoside
GD156303
Name:
2-({3,15-dihydroxy-16,17-dimethoxytricyclo[12.3.1.1²,â¶]nonadeca-1(18),2,4,6(19),14,16-hexaen-9-yl}oxy)oxane-3,4,5-triolFormula:
C26H34O9Smiles:
COc1c2cc(c(O)c1OC)CCCCC(OC1OCC(O)C(O)C1O)CCc1ccc(O)c-2c1Aglycone:
COc1c2cc(c(O)c1OC)CCCCC(O)CCc1ccc(O)c-2c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 490.55 | Num_heavy_atoms: | 35 |
| TPSA: | 138.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD14175
Formula: C21H26O5
Smiles:
COc1c2cc(c(O)c1OC)CCCCC(O)CCc1ccc(O)c-2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 3.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 358.43 | Num_heavy_atoms: | 26 |
| TPSA: | 79.15 | NumAromaticRings: | 2 |
