Glycoside
GD148133
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3-hydroxy-5,6,8a-trimethyl-5-[2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl]-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylateFormula:
C26H38O10Smiles:
CC1CCC2(C)C(C(=O)OC3OC(CO)C(O)C(O)C3O)=CC(O)CC2C1(C)CCC1=CC(=O)OC1Aglycone:
CC1CCC2(C)C(C(=O)O)=CC(O)CC2C1(C)CCC1=CC(=O)OC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 510.58 | Num_heavy_atoms: | 36 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD59291
Formula: C20H28O5
Smiles:
CC1CCC2(C)C(C(=O)O)=CC(O)CC2C1(C)CCC1=CC(=O)OC1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | 3.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.44 | Num_heavy_atoms: | 25 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
