Glycoside
GD147176
Name:
5-methoxy-2,2,8-trimethyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,3H,4H,10H-pyrano[2,3-f]chromen-10-oneFormula:
C22H28O10Smiles:
COc1cc2oc(C)cc(=O)c2c2c1CC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)O2Aglycone:
COc1cc2oc(C)cc(=O)c2c2c1CC(O)C(C)(C)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 452.46 | Num_heavy_atoms: | 32 |
| TPSA: | 148.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD58953
Formula: C16H18O5
Smiles:
COc1cc2oc(C)cc(=O)c2c2c1CC(O)C(C)(C)O2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 290.31 | Num_heavy_atoms: | 21 |
| TPSA: | 68.9 | NumAromaticRings: | 2 |
