Glycoside
GD147821
Name:
2-(3,4-dihydroxyphenyl)-8-(1,2,3,4,5,6-hexahydroxyhexyl)-5,7-dihydroxy-4H-chromen-4-oneFormula:
C21H22O12Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2c(C(O)C(O)C(O)C(O)C(O)CO)c(O)cc(O)c12Aglycone:
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12Sugarmoiety:
OCC(O)C(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.29 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 7 |
| MolWt: | 466.4 | Num_heavy_atoms: | 33 |
| TPSA: | 232.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD00567
Formula: C15H10O6
Smiles:
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 286.24 | Num_heavy_atoms: | 21 |
| TPSA: | 111.13 | NumAromaticRings: | 3 |
