Glycoside
GD126824
Name:
13-oxo-7-{[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxy}tetradecanoic acidFormula:
C21H38O9Smiles:
COCC1OC(OC(CCCCCC(C)=O)CCCCCC(=O)O)C(O)C(O)C1OAglycone:
CC(=O)CCCCCC(O)CCCCCC(=O)OSugarmoiety:
COCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 16 |
| MolWt: | 434.53 | Num_heavy_atoms: | 30 |
| TPSA: | 142.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD51334
Formula: C14H26O4
Smiles:
CC(=O)CCCCCC(O)CCCCCC(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 12 |
| MolWt: | 258.36 | Num_heavy_atoms: | 18 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
