Glycoside
GD126814
Name:
7-(2-hydroxy-3-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butoxy)-6-methoxy-2H-chromen-2-oneFormula:
C21H28O11Smiles:
COc1cc2ccc(=O)oc2cc1OCC(O)C(C)(C)OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc2ccc(=O)oc2cc1OCC(O)C(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 8 |
| MolWt: | 456.44 | Num_heavy_atoms: | 32 |
| TPSA: | 168.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD51330
Formula: C15H18O6
Smiles:
COc1cc2ccc(=O)oc2cc1OCC(O)C(C)(C)O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 294.3 | Num_heavy_atoms: | 21 |
| TPSA: | 89.13 | NumAromaticRings: | 2 |
