Glycoside
GD151419
Name:
5-ethenyl-1-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,3H,4H,4aH,5H,6H-pyrano[3,4-c]pyran-3-yl 2-methylbut-2-enoateFormula:
C21H28O11Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC(=O)C(C)=CC)CC21Aglycone:
C=CC1C(O)OC=C2C(=O)OC(OC(=O)C(C)=CC)CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 6 |
| MolWt: | 456.44 | Num_heavy_atoms: | 32 |
| TPSA: | 161.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD60395
Formula: C15H18O6
Smiles:
C=CC1C(O)OC=C2C(=O)OC(OC(=O)C(C)=CC)CC21| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 294.3 | Num_heavy_atoms: | 21 |
| TPSA: | 82.06 | NumAromaticRings: | 0 |
