Glycoside
GD145828
Name:
2-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-2-en-1-yl 4-hydroxybenzoateFormula:
C18H24O9Smiles:
CC(=CCOC1OC(CO)C(O)C(O)C1O)COC(=O)c1ccc(O)cc1Aglycone:
CC(=CCO)COC(=O)c1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 7 |
| MolWt: | 384.38 | Num_heavy_atoms: | 27 |
| TPSA: | 145.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD58511
Formula: C12H14O4
Smiles:
CC(=CCO)COC(=O)c1ccc(O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 222.24 | Num_heavy_atoms: | 16 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
