Glycoside
GD149245
Name:
methyl 4-(2,2-dibutoxyethyl)-3-ethenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylateFormula:
C25H42O11Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OCCCC)OCCCCAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1CC(OCCCC)OCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.8 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 15 |
| MolWt: | 518.6 | Num_heavy_atoms: | 36 |
| TPSA: | 153.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD59686
Formula: C19H32O6
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1CC(OCCCC)OCCCC| HBA: | 6 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.74 |
| AlogP: | 3.16 | Num_rotatable_bonds: | 12 |
| MolWt: | 356.46 | Num_heavy_atoms: | 25 |
| TPSA: | 74.22 | NumAromaticRings: | 0 |
