Glycoside
GD104115
Name:
6'-hydroxy-3'-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3H-spiro[2-benzofuran-1,9'-xanthen]-3-oneFormula:
C26H22O10Smiles:
O=C1O[C@]2(c3ccc(O)cc3Oc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)ccc32)c2ccccc21Aglycone:
O=C1OC2(c3ccc(O)cc3Oc3cc(O)ccc32)c2ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 494.45 | Num_heavy_atoms: | 36 |
| TPSA: | 155.14 | NumAromaticRings: | 3 |
Unique Aglycone
AD43965
Formula: C20H12O5
Smiles:
O=C1OC2(c3ccc(O)cc3Oc3cc(O)ccc32)c2ccccc21| HBA: | 5 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 0 |
| MolWt: | 332.31 | Num_heavy_atoms: | 25 |
| TPSA: | 75.99 | NumAromaticRings: | 3 |
