Glycoside
GD119365
Name:
2-(3-{5-[(3,3-dimethyloxiran-2-yl)methyl]-6-hydroxy-1-benzofuran-2-yl}-5-hydroxyphenoxy)oxane-3,4,5-triolFormula:
C24H26O9Smiles:
CC1(C)OC1Cc1cc2cc(-c3cc(O)cc(OC4OCC(O)C(O)C4O)c3)oc2cc1OAglycone:
CC1(C)OC1Cc1cc2cc(-c3cc(O)cc(O)c3)oc2cc1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 458.46 | Num_heavy_atoms: | 33 |
| TPSA: | 145.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD47808
Formula: C19H18O5
Smiles:
CC1(C)OC1Cc1cc2cc(-c3cc(O)cc(O)c3)oc2cc1O| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.26 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 326.35 | Num_heavy_atoms: | 24 |
| TPSA: | 86.36 | NumAromaticRings: | 3 |
