Glycoside
GD140557
Name:
3-methyl-6,9-dimethylidene-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-dodecahydroazuleno[4,5-b]furan-2-oneFormula:
C21H30O8Smiles:
C=C1CC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)OC2C2C(=C)CCC12Aglycone:
C=C1CC(O)C2C(C)C(=O)OC2C2C(=C)CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.76 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 410.46 | Num_heavy_atoms: | 29 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD56672
Formula: C15H20O3
Smiles:
C=C1CC(O)C2C(C)C(=O)OC2C2C(=C)CCC12| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 0 |
| MolWt: | 248.32 | Num_heavy_atoms: | 18 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
