Glycoside
GD130712
Name:
2-{[2-(3-hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methoxy}-6-methyloxane-3,4,5-triolFormula:
C26H34O10Smiles:
COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2COC2OC(C)C(O)C(O)C2O)cc1OAglycone:
COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 9 |
| MolWt: | 506.55 | Num_heavy_atoms: | 36 |
| TPSA: | 147.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD52966
Formula: C20H24O6
Smiles:
COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 7 |
| MolWt: | 360.41 | Num_heavy_atoms: | 26 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
