Glycoside
GD154006
Name:
2-{[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]oxy}-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C21H36O10Smiles:
C=C(C)C(CC=C(C)C)COC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1OAglycone:
C=C(C)C(CO)CC=C(C)CSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.81 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 448.51 | Num_heavy_atoms: | 31 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD61207
Formula: C10H18O
Smiles:
C=C(C)C(CO)CC=C(C)C| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 4 |
| MolWt: | 154.25 | Num_heavy_atoms: | 11 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
