Glycoside
GD144488
Name:
1-{2,4-dihydroxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]phenyl}-3-(3,4-dihydroxyphenyl)-2-hydroxypropan-1-oneFormula:
C20H22O11Smiles:
O=C(c1ccc(O)c(OC2OCC(O)C(O)C2O)c1O)C(O)Cc1ccc(O)c(O)c1Aglycone:
O=C(c1ccc(O)c(O)c1O)C(O)Cc1ccc(O)c(O)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.35 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 438.39 | Num_heavy_atoms: | 31 |
| TPSA: | 197.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD45788
Formula: C15H14O7
Smiles:
O=C(c1ccc(O)c(O)c1O)C(O)Cc1ccc(O)c(O)c1| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.13 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 306.27 | Num_heavy_atoms: | 22 |
| TPSA: | 138.45 | NumAromaticRings: | 2 |
