Glycoside
GD031942
Name:
NoneFormula:
C50H99O12NSmiles:
CCCCCCCCCCCCCCCCCCCCCC[C@H](O)[C@H](O)[C@H](O)C(=O)N[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCC(O)C(O)C([NH])CO.CCCCCCCCCCCCCCCCCCCCCCSugarmoiety:
O=CC(O)C(O)CO.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 10 | FractionCSP3: | 0.98 |
| AlogP: | 7.4 | Num_rotatable_bonds: | 44 |
| MolWt: | 906.34 | Num_heavy_atoms: | 63 |
| TPSA: | 229.63 | NumAromaticRings: | 0 |
Unique Aglycone
AD20531
Formula: C18H38O3N
Smiles:
CCCCCCCCCCCCCCC(O)C(O)C([NH])CO| HBA: | 4 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 3.44 | Num_rotatable_bonds: | 16 |
| MolWt: | 316.51 | Num_heavy_atoms: | 22 |
| TPSA: | 84.49 | NumAromaticRings: | 0 |
AD20532
Formula: C22H46
Smiles:
CCCCCCCCCCCCCCCCCCCCCC| HBA: | 0 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 8.83 | Num_rotatable_bonds: | 19 |
| MolWt: | 310.61 | Num_heavy_atoms: | 22 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
