Glycoside
GD154372
Name:
JasmesosideFormula:
C27H42O13Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(=O)OCC1C(C)C(O)CC1C(C)COAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1CC(=O)OCC1C(C)C(O)CC1C(C)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.78 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 11 |
| MolWt: | 574.62 | Num_heavy_atoms: | 40 |
| TPSA: | 201.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD61324
Formula: C21H32O8
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1CC(=O)OCC1C(C)C(O)CC1C(C)CO| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 8 |
| MolWt: | 412.48 | Num_heavy_atoms: | 29 |
| TPSA: | 122.52 | NumAromaticRings: | 0 |
