Glycoside
GD129202
Name:
methyl 2-(hydroxymethyl)-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,â´]dec-7-ene-7-carboxylateFormula:
C17H24O11Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC1OC12COAglycone:
COC(=O)C1=COC(O)C2C1CC1OC12COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.82 |
| AlogP: | -3.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.37 | Num_heavy_atoms: | 28 |
| TPSA: | 167.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD52339
Formula: C11H14O6
Smiles:
COC(=O)C1=COC(O)C2C1CC1OC12CO| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.23 | Num_heavy_atoms: | 17 |
| TPSA: | 88.52 | NumAromaticRings: | 0 |
