Glycoside
GD153234
Name:
6-(3,5-dihydroxyoxan-2-yl)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-oneFormula:
C26H28O15Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(OC3OC(CO)C(O)C(O)C3O)c(O)c(C3OCC(O)CC3O)c(O)c12Aglycone:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)c(O)c(C3OCC(O)CC3O)c(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.42 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 580.5 | Num_heavy_atoms: | 41 |
| TPSA: | 260.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD60961
Formula: C20H18O10
Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)c(O)c(C3OCC(O)CC3O)c(O)c12| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.25 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 418.35 | Num_heavy_atoms: | 30 |
| TPSA: | 181.05 | NumAromaticRings: | 3 |
