Glycoside
GD127736
Name:
2-[2-hydroxy-4-(3-hydroxyprop-1-en-1-yl)-6-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H22O9Smiles:
COc1cc(C=CCO)cc(O)c1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C=CCO)cc(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 358.34 | Num_heavy_atoms: | 25 |
| TPSA: | 149.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD51738
Formula: C10H12O4
Smiles:
COc1cc(C=CCO)cc(O)c1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 196.2 | Num_heavy_atoms: | 14 |
| TPSA: | 69.92 | NumAromaticRings: | 1 |
