Glycoside
GD133967
Name:
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 2-(4a,8-dimethyl-7-oxo-1,2,3,4,4a,5,6,7-octahydronaphthalen-2-yl)prop-2-enoateFormula:
C21H30O8Smiles:
C=C(C(=O)OCC1OC(O)C(O)C(O)C1O)C1CCC2(C)CCC(=O)C(C)=C2C1Aglycone:
C=C(C(=O)OC)C1CCC2(C)CCC(=O)C(C)=C2C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.46 | Num_heavy_atoms: | 29 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD54199
Formula: C16H22O3
Smiles:
C=C(C(=O)OC)C1CCC2(C)CCC(=O)C(C)=C2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.62 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.35 | Num_heavy_atoms: | 19 |
| TPSA: | 43.37 | NumAromaticRings: | 0 |
