Glycoside
GD143401
Name:
6-hydroxy-5-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C16H18O9Smiles:
Cc1c(O)ccc2oc(=O)cc(OC3OC(CO)C(O)C(O)C3O)c12Aglycone:
Cc1c(O)ccc2oc(=O)cc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 354.31 | Num_heavy_atoms: | 25 |
| TPSA: | 149.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD57679
Formula: C10H8O4
Smiles:
Cc1c(O)ccc2oc(=O)cc(O)c12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 0 |
| MolWt: | 192.17 | Num_heavy_atoms: | 14 |
| TPSA: | 70.67 | NumAromaticRings: | 2 |
