Glycoside
GD136724
Name:
3,3,5-trimethyl-4-(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-1-en-1-yl)cyclohexan-1-oneFormula:
C19H32O7Smiles:
CC(C=CC1C(C)CC(=O)CC1(C)C)OC1OC(CO)C(O)C(O)C1OAglycone:
CC(O)C=CC1C(C)CC(=O)CC1(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.84 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 372.46 | Num_heavy_atoms: | 26 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD55270
Formula: C13H22O2
Smiles:
CC(O)C=CC1C(C)CC(=O)CC1(C)C| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.77 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 210.32 | Num_heavy_atoms: | 15 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
