Glycoside
GD115656
Name:
2-(3,4-dihydroxyphenyl)-7-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]methyl}-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C22H24O10Smiles:
O=C1CC(c2ccc(O)c(O)c2)Oc2cc(O)c(CC3OC(CO)C(O)C(O)C3O)cc21Aglycone:
Cc1cc2c(cc1O)OC(c1ccc(O)c(O)c1)CC2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.41 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 448.42 | Num_heavy_atoms: | 32 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD45791
Formula: C16H14O5
Smiles:
Cc1cc2c(cc1O)OC(c1ccc(O)c(O)c1)CC2=O| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.19 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 1 |
| MolWt: | 286.28 | Num_heavy_atoms: | 21 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
