Glycoside
GD135462
Name:
7-hydroxy-5-methoxy-2-{4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}-6-(3,4,5-trihydroxyoxan-2-yl)-4H-chromen-4-oneFormula:
C27H30O13Smiles:
COc1c(C2OCC(O)C(O)C2O)c(O)cc2oc(-c3ccc(OC4OC(C)C(O)C(O)C4O)cc3)cc(=O)c12Aglycone:
COc1cc(O)cc2oc(-c3ccc(O)cc3)cc(=O)c12Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.44 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 562.52 | Num_heavy_atoms: | 40 |
| TPSA: | 208.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD01046
Formula: C16H12O5
Smiles:
COc1cc(O)cc2oc(-c3ccc(O)cc3)cc(=O)c12| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 2.88 | Num_rotatable_bonds: | 2 |
| MolWt: | 284.27 | Num_heavy_atoms: | 21 |
| TPSA: | 79.9 | NumAromaticRings: | 3 |
