Glycoside
GD129798
Name:
2-[2-hydroxy-4-(prop-2-en-1-yl)phenoxy]-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triolFormula:
C21H30O12Smiles:
C=CCc1ccc(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)c(O)c1Aglycone:
C=CCc1ccc(O)c(O)c1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.62 |
| AlogP: | -2.88 | Num_rotatable_bonds: | 8 |
| MolWt: | 474.46 | Num_heavy_atoms: | 33 |
| TPSA: | 198.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD15457
Formula: C9H10O2
Smiles:
C=CCc1ccc(O)c(O)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 150.18 | Num_heavy_atoms: | 11 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
