Glycoside
GD142973
Name:
2,3,4-trihydroxy-6-[(3-hydroxy-2-tetradecyloctadecanoyl)oxy]-5-oxohexyl 3-hydroxy-2-tetradecyloctadecanoateFormula:
C70H136O10Smiles:
CCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCCCCC)C(=O)OCC(=O)C(O)C(O)C(O)COC(=O)C(CCCCCCCCCCCCCC)C(O)CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCC(O)C(C=O)CCCCCCCCCCCCCC.CCCCCCCCCCCCCCCC(O)C(C=O)CCCCCCCCCCCCCCSugarmoiety:
O=C(COO)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 10 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.96 |
| AlogP: | 18.82 | Num_rotatable_bonds: | 65 |
| MolWt: | 1137.85 | Num_heavy_atoms: | 80 |
| TPSA: | 170.82 | NumAromaticRings: | 0 |
Unique Aglycone
AD55867
Formula: C32H64O2
Smiles:
CCCCCCCCCCCCCCCC(O)C(C=O)CCCCCCCCCCCCCC| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.97 |
| AlogP: | 10.73 | Num_rotatable_bonds: | 29 |
| MolWt: | 480.86 | Num_heavy_atoms: | 34 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
