Glycoside
GD146938
Name:
[6-(hexadec-7-enoyloxy)-3,4,5-trihydroxyoxan-2-yl]methyl octadecanoateFormula:
C40H74O8Smiles:
CCCCCCCCC=CCCCCCC(=O)OC1OC(COC(=O)CCCCCCCCCCCCCCCCC)C(O)C(O)C1OAglycone:
CCCCCCCCC=CCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)OCSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 9.4 | Num_rotatable_bonds: | 32 |
| MolWt: | 683.02 | Num_heavy_atoms: | 48 |
| TPSA: | 122.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD02574
Formula: C19H38O2
Smiles:
CCCCCCCCCCCCCCCCCC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.95 |
| AlogP: | 6.42 | Num_rotatable_bonds: | 16 |
| MolWt: | 298.51 | Num_heavy_atoms: | 21 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
AD58873
Formula: C16H30O2
Smiles:
CCCCCCCCC=CCCCCCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.81 |
| AlogP: | 5.33 | Num_rotatable_bonds: | 13 |
| MolWt: | 254.41 | Num_heavy_atoms: | 18 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
