Glycoside
GD147660
Name:
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4a,8a-dihydro-4H-chromen-4-oneFormula:
C21H22O11Smiles:
O=C1C(OC2OC(CO)C(O)C(O)C2O)=C(c2ccc(O)cc2)OC2C=C(O)C=C(O)C12Aglycone:
O=C1C(O)=C(c2ccc(O)cc2)OC2C=C(O)C=C(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 450.4 | Num_heavy_atoms: | 32 |
| TPSA: | 186.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD59126
Formula: C15H12O6
Smiles:
O=C1C(O)=C(c2ccc(O)cc2)OC2C=C(O)C=C(O)C12| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.13 |
| AlogP: | 2.1 | Num_rotatable_bonds: | 1 |
| MolWt: | 288.26 | Num_heavy_atoms: | 21 |
| TPSA: | 107.22 | NumAromaticRings: | 1 |
