Glycoside
GD127664
Name:
9-oxo-16-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadecanoic acidFormula:
C22H40O9Smiles:
O=C(O)CCCCCCCC(=O)CCCCCCCOC1OC(CO)C(O)C(O)C1OAglycone:
O=C(O)CCCCCCCC(=O)CCCCCCCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.91 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 18 |
| MolWt: | 448.55 | Num_heavy_atoms: | 31 |
| TPSA: | 153.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD51697
Formula: C16H30O4
Smiles:
O=C(O)CCCCCCCC(=O)CCCCCCCO| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.88 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 15 |
| MolWt: | 286.41 | Num_heavy_atoms: | 20 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
