Glycoside
GD117374
Name:
2-{[4,5-dihydroxy-6-(hydroxymethyl)-2-(2,3,4-trimethoxyphenoxy)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C21H32O13Smiles:
COc1ccc(OC2OC(CO)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)c(OC)c1OCAglycone:
COc1ccc(O)c(OC)c1OCSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -2.26 | Num_rotatable_bonds: | 8 |
| MolWt: | 492.47 | Num_heavy_atoms: | 34 |
| TPSA: | 185.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD46786
Formula: C9H12O4
Smiles:
COc1ccc(O)c(OC)c1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 47.92 | NumAromaticRings: | 1 |
