Glycoside
GD118445
Name:
(5-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,3H,4H,4aH,5H,7aH-cyclopenta[c]pyran-7-yl)methyl 3-phenylprop-2-enoateFormula:
C24H30O10Smiles:
O=C(C=Cc1ccccc1)OCC1=CC(O)C2CCOC(OC3OC(CO)C(O)C(O)C3O)C12Aglycone:
O=C(C=Cc1ccccc1)OCC1=CC(O)C2CCOC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 478.49 | Num_heavy_atoms: | 34 |
| TPSA: | 155.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD47360
Formula: C18H20O5
Smiles:
O=C(C=Cc1ccccc1)OCC1=CC(O)C2CCOC(O)C12| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.39 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 316.35 | Num_heavy_atoms: | 23 |
| TPSA: | 75.99 | NumAromaticRings: | 1 |
