Glycoside
GD115973
Name:
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4H-chromen-4-oneFormula:
C22H22O12Smiles:
O=c1c(COC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12Aglycone:
O=c1c(CO)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.32 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 478.41 | Num_heavy_atoms: | 34 |
| TPSA: | 210.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD12573
Formula: C16H12O7
Smiles:
O=c1c(CO)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.06 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 2 |
| MolWt: | 316.27 | Num_heavy_atoms: | 23 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
