Glycoside
GD143589
Name:
6,8-dihydroxy-3-(4-hydroxy-3-methoxyphenyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,4-dihydronaphthalen-1-oneFormula:
C23H24O11Smiles:
COc1cc(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)c3c(O)cc(O)cc3C2)ccc1OAglycone:
COc1cc(C2=C(O)C(=O)c3c(O)cc(O)cc3C2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 476.43 | Num_heavy_atoms: | 34 |
| TPSA: | 186.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD57744
Formula: C17H14O6
Smiles:
COc1cc(C2=C(O)C(=O)c3c(O)cc(O)cc3C2)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.12 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 314.29 | Num_heavy_atoms: | 23 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
