Glycoside
GD124707
Name:
2-{4-[5-(1-hydroxycyclopropyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H32O11Smiles:
COc1cc(C2Oc3c(OC)cc(C4(O)CC4)cc3C2CO)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C2Oc3c(OC)cc(C4(O)CC4)cc3C2CO)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 520.53 | Num_heavy_atoms: | 37 |
| TPSA: | 167.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD50398
Formula: C20H22O6
Smiles:
COc1cc(C2Oc3c(OC)cc(C4(O)CC4)cc3C2CO)ccc1O| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 2.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 358.39 | Num_heavy_atoms: | 26 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
