Glycoside
GD132353
Name:
Polygalaxanthone IvFormula:
C27H32O15Smiles:
COc1cc(O)c2c(=O)c3cc(OC)c(OC4OC(CO)C(O)C(O)C4OC4OC(C)C(O)C(O)C4O)cc3oc2c1Aglycone:
COc1cc(O)c2c(=O)c3cc(OC)c(O)cc3oc2c1Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.52 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 596.54 | Num_heavy_atoms: | 42 |
| TPSA: | 227.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD53585
Formula: C15H12O6
Smiles:
COc1cc(O)c2c(=O)c3cc(OC)c(O)cc3oc2c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.25 | Num_heavy_atoms: | 21 |
| TPSA: | 89.13 | NumAromaticRings: | 3 |
