Glycoside
GD027062
Name:
NoneFormula:
C42H84O5NSmiles:
CCCCCCCCCCCCCCO[C@H]1[C@@H](OCCCCCCCCCCCCCC)[C@H](O)[C@@H](C[N+](C)(C)C2CCCC2)O[C@H]1OCAglycone:
CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.C[N+](C)(C)C1CCCC1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 10.91 | Num_rotatable_bonds: | 32 |
| MolWt: | 683.14 | Num_heavy_atoms: | 48 |
| TPSA: | 57.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD00065
Formula: C14H30O
Smiles:
CCCCCCCCCCCCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 4.68 | Num_rotatable_bonds: | 12 |
| MolWt: | 214.39 | Num_heavy_atoms: | 15 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
AD17810
Formula: C8H18N
Smiles:
C[N+](C)(C)C1CCCC1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 128.24 | Num_heavy_atoms: | 9 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
