Glycoside
GD146434
Name:
2-(4-{1,3-dihydroxy-2-[4-(3-hydroxypropyl)-2-methoxyphenoxy]propyl}-2-methoxyphenyl)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H36O11Smiles:
COc1cc(CCCO)ccc1OC(CO)C(O)c1ccc(C2OC(CO)C(O)C(O)C2O)c(OC)c1Aglycone:
COc1cccc(C(O)C(CO)Oc2ccc(CCCO)cc2OC)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 12 |
| MolWt: | 524.56 | Num_heavy_atoms: | 37 |
| TPSA: | 178.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD58721
Formula: C20H26O6
Smiles:
COc1cccc(C(O)C(CO)Oc2ccc(CCCO)cc2OC)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 2.1 | Num_rotatable_bonds: | 10 |
| MolWt: | 362.42 | Num_heavy_atoms: | 26 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
