Glycoside
GD125706
Name:
Monoacyldiglycosyl-MonoacylglycerolFormula:
C47H88O15Smiles:
CCCCCCCCCCCCCCCC(=O)OCC(O)COC1OC(COC(=O)CCCCCCCCCCCCCCC)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OAglycone:
CCCCCCCCCCCCCCCC(=O)OC.CCCCCCCCCCCCCCCC(=O)OCC(O)COSugarmoiety:
OCC1OC(OC(O)C(O)C(O)OCC(O)O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.96 |
| AlogP: | 6.04 | Num_rotatable_bonds: | 38 |
| MolWt: | 893.21 | Num_heavy_atoms: | 62 |
| TPSA: | 231.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD01838
Formula: C19H38O4
Smiles:
CCCCCCCCCCCCCCCC(=O)OCC(O)CO| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.95 |
| AlogP: | 4.36 | Num_rotatable_bonds: | 17 |
| MolWt: | 330.51 | Num_heavy_atoms: | 23 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD03475
Formula: C17H34O2
Smiles:
CCCCCCCCCCCCCCCC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.94 |
| AlogP: | 5.64 | Num_rotatable_bonds: | 14 |
| MolWt: | 270.46 | Num_heavy_atoms: | 19 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
