Glycoside
GD122069
Name:
2-{[2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxyprop-1-en-1-yl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methoxy}-6-(hydroxymethyl)-5-methoxyoxane-3,4-diolFormula:
C27H34O11Smiles:
COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2COC2OC(CO)C(OC)C(O)C2O)ccc1OAglycone:
COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1OSugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 10 |
| MolWt: | 534.56 | Num_heavy_atoms: | 38 |
| TPSA: | 156.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD04143
Formula: C20H22O6
Smiles:
COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 6 |
| MolWt: | 358.39 | Num_heavy_atoms: | 26 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
