Glycoside
GD146471
Name:
2-(oct-1-en-3-yloxy)-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triolFormula:
C20H36O11Smiles:
C=CC(CCCCC)OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
C=CC(O)CCCCCSugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.9 |
| AlogP: | -2.24 | Num_rotatable_bonds: | 11 |
| MolWt: | 452.5 | Num_heavy_atoms: | 31 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD04132
Formula: C8H16O
Smiles:
C=CC(O)CCCCC| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 128.22 | Num_heavy_atoms: | 9 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
