Glycoside
GD155073
Name:
methyl 4-hydroxy-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10-dioxatricyclo[5.3.1.0â´,â¸]undec-5-ene-11-carboxylateFormula:
C17H24O11Smiles:
COC(=O)C1C2OCC3(O)C=CC1C3C(OC1OC(CO)C(O)C(O)C1O)O2Aglycone:
COC(=O)C1C2OCC3(O)C=CC1C3C(O)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.82 |
| AlogP: | -3.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.37 | Num_heavy_atoms: | 28 |
| TPSA: | 164.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD61542
Formula: C11H14O6
Smiles:
COC(=O)C1C2OCC3(O)C=CC1C3C(O)O2| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.23 | Num_heavy_atoms: | 17 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
