Glycoside
GD135872
Name:
4,4a,7,8-tetramethyl-8-{3-methyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]pent-4-en-1-yl}-1,2,4a,5,6,7,8,8a-octahydronaphthalen-2-oneFormula:
C25H40O6Smiles:
C=CC(C)(CCC1(C)C(C)CCC2(C)C(C)=CC(=O)CC21)OC1OCC(O)C(O)C1OAglycone:
C=CC(C)(O)CCC1(C)C(C)CCC2(C)C(C)=CC(=O)CC21Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 3.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.59 | Num_heavy_atoms: | 31 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD54934
Formula: C20H32O2
Smiles:
C=CC(C)(O)CCC1(C)C(C)CCC2(C)C(C)=CC(=O)CC21| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 4.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 304.47 | Num_heavy_atoms: | 22 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
