Glycoside
GD133214
Name:
methyl 7-methylidene-1-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylateFormula:
C23H34O13Smiles:
C=C1CCC2C(C(=O)OC)=COC(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C12Aglycone:
C=C1CCC2C(C(=O)OC)=COC(O)C12Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.78 |
| AlogP: | -2.35 | Num_rotatable_bonds: | 6 |
| MolWt: | 518.51 | Num_heavy_atoms: | 36 |
| TPSA: | 193.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD53929
Formula: C11H14O4
Smiles:
C=C1CCC2C(C(=O)OC)=COC(O)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 1 |
| MolWt: | 210.23 | Num_heavy_atoms: | 15 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
