Glycoside
GD076606
Name:
3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-oneFormula:
C19H22O8Smiles:
O=c1oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2c2c1CCCC2Aglycone:
O=c1oc2cc(O)ccc2c2c1CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 378.38 | Num_heavy_atoms: | 27 |
| TPSA: | 129.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD30272
Formula: C13H12O3
Smiles:
O=c1oc2cc(O)ccc2c2c1CCCC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.31 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 0 |
| MolWt: | 216.24 | Num_heavy_atoms: | 16 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
