Glycoside
GD008349
Name:
NoneFormula:
C27H51O6NSmiles:
C=CCCC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCCCCCCCCCCCCCCCCAglycone:
C=CCCC(N)=O.CCCCCCCCCCCCCCCCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.89 |
| AlogP: | 4.37 | Num_rotatable_bonds: | 21 |
| MolWt: | 485.71 | Num_heavy_atoms: | 34 |
| TPSA: | 108.25 | NumAromaticRings: | 0 |
Unique Aglycone
AD01052
Formula: C16H34O
Smiles:
CCCCCCCCCCCCCCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 5.46 | Num_rotatable_bonds: | 14 |
| MolWt: | 242.45 | Num_heavy_atoms: | 17 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
AD03794
Formula: C5H9ON
Smiles:
C=CCCC(N)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 43.09 | NumAromaticRings: | 0 |
