Glycoside
GD138762
Name:
5-hydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-(2,3,4-trimethoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C24H28O12Smiles:
COc1ccc(C2COc3cc(OC4OC(CO)C(O)C(O)C4O)cc(O)c3C2=O)c(OC)c1OCAglycone:
COc1ccc(C2COc3cc(O)cc(O)c3C2=O)c(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 508.48 | Num_heavy_atoms: | 36 |
| TPSA: | 173.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD55983
Formula: C18H18O7
Smiles:
COc1ccc(C2COc3cc(O)cc(O)c3C2=O)c(OC)c1OC| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.28 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.34 | Num_heavy_atoms: | 25 |
| TPSA: | 94.45 | NumAromaticRings: | 2 |
