Glycoside
GD127461
Name:
5-hydroxy-6-(methoxymethyl)-2-(4-methoxyphenyl)-8-methyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C25H30O11Smiles:
COCc1c(O)c2c(c(C)c1OC1OC(CO)C(O)C(O)C1O)OC(c1ccc(OC)cc1)CC2=OAglycone:
COCc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(OC)cc1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 7 |
| MolWt: | 506.5 | Num_heavy_atoms: | 36 |
| TPSA: | 164.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD51614
Formula: C19H20O6
Smiles:
COCc1c(O)c(C)c2c(c1O)C(=O)CC(c1ccc(OC)cc1)O2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.32 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.36 | Num_heavy_atoms: | 25 |
| TPSA: | 85.22 | NumAromaticRings: | 2 |
