Glycoside
GD124176
Name:
2-{[2-(3,4-dimethoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C27H36O11Smiles:
COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2COC2OC(CO)C(O)C(O)C2O)cc1OCAglycone:
COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 11 |
| MolWt: | 536.57 | Num_heavy_atoms: | 38 |
| TPSA: | 156.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD50143
Formula: C21H26O6
Smiles:
COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1OC| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 8 |
| MolWt: | 374.43 | Num_heavy_atoms: | 27 |
| TPSA: | 77.38 | NumAromaticRings: | 2 |
