Glycoside
GD143237
Name:
Amritoside AFormula:
C26H36O13Smiles:
COC(=O)C1=C2C(OC3OC(CO)C(O)C(O)C3O)CC(O)(C(=O)O)C(C)(CC(O)c3ccoc3)C2CCC1Aglycone:
COC(=O)C1=C2C(O)CC(O)(C(=O)O)C(C)(CC(O)c3ccoc3)C2CCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.69 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 8 |
| MolWt: | 556.56 | Num_heavy_atoms: | 39 |
| TPSA: | 216.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD57619
Formula: C20H26O8
Smiles:
COC(=O)C1=C2C(O)CC(O)(C(=O)O)C(C)(CC(O)c3ccoc3)C2CCC1| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 394.42 | Num_heavy_atoms: | 28 |
| TPSA: | 137.43 | NumAromaticRings: | 1 |
