Glycoside
GD121823
Name:
(+)-4'-Methylgallocatechin 3'-O-Beta-GlucopyranosideFormula:
C22H26O12Smiles:
COc1c(O)cc(C2Oc3cc(O)cc(O)c3CC2O)cc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1c(O)cc(C2Oc3cc(O)cc(O)c3CC2O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.45 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 482.44 | Num_heavy_atoms: | 34 |
| TPSA: | 198.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD47941
Formula: C16H16O7
Smiles:
COc1c(O)cc(C2Oc3cc(O)cc(O)c3CC2O)cc1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 2 |
| MolWt: | 320.3 | Num_heavy_atoms: | 23 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
