Glycoside
GD020860
Name:
NoneFormula:
C46H76O10NSmiles:
CCC[N+](CCC)(CCC)CCCC(=O)O[C@@H]1CCC[C@H](CC)OC(=O)C[C@@H]2C(=C[C@H]3[C@H]4C[C@@H](O[C@@H]5O[C@H](C)[C@H](OC)[C@H](OC)[C@H]5OC)C[C@H]4C=C[C@@H]23)C(=O)[C@H]1CAglycone:
CCC[N+](CCC)(CCC)CCCC(=O)OC1CCCC(CC)OC(=O)CC2C(=CC3C2C=CC2CC(O)CC23)C(=O)C1CSugarmoiety:
COC1C(C)OC(O)C(OC)C1OCOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.85 |
| AlogP: | 7.39 | Num_rotatable_bonds: | 17 |
| MolWt: | 803.11 | Num_heavy_atoms: | 57 |
| TPSA: | 115.82 | NumAromaticRings: | 0 |
Unique Aglycone
AD14333
Formula: C37H60O6N
Smiles:
CCC[N+](CCC)(CCC)CCCC(=O)OC1CCCC(CC)OC(=O)CC2C(=CC3C2C=CC2CC(O)CC23)C(=O)C1C| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.81 |
| AlogP: | 6.57 | Num_rotatable_bonds: | 12 |
| MolWt: | 614.89 | Num_heavy_atoms: | 44 |
| TPSA: | 89.9 | NumAromaticRings: | 0 |
