Glycoside
GD136589
Name:
2-{[5-hydroxy-2-(hydroxymethyl)-5-methoxy-3,9-dioxatricyclo[4.4.0.0²,â´]dec-7-en-10-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H24O11Smiles:
COC1(O)C2C=COC(OC3OC(CO)C(O)C(O)C3O)C2C2(CO)OC12Aglycone:
COC1(O)C2C=COC(O)C2C2(CO)OC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -3.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 392.36 | Num_heavy_atoms: | 27 |
| TPSA: | 170.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD55220
Formula: C10H14O6
Smiles:
COC1(O)C2C=COC(O)C2C2(CO)OC12| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 230.22 | Num_heavy_atoms: | 16 |
| TPSA: | 91.68 | NumAromaticRings: | 0 |
