Glycoside

GD024746
Name:
NoneFormula:
C40H76O14N2Smiles:
CCCCCCCCCCCCCC[C@H](O)[C@H](O)[C@H](CO[C@@H]1O[C@H](CNC(C)=O)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCAglycone:
CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCC.CNC(C)=OSugarmoiety:
OCC1OC(OC2C(O)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 2 |
HBD: | 10 | FractionCSP3: | 0.95 |
AlogP: | 1.43 | Num_rotatable_bonds: | 30 |
MolWt: | 809.05 | Num_heavy_atoms: | 56 |
TPSA: | 256.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD01019
Formula: C3H7ON
Smiles:
CNC(C)=OHBA: | 2 | RingCount: | 0 |
HBD: | 1 | FractionCSP3: | 0.67 |
AlogP: | -0.25 | Num_rotatable_bonds: | 0 |
MolWt: | 73.09 | Num_heavy_atoms: | 5 |
TPSA: | 29.1 | NumAromaticRings: | 0 |
AD14316
Formula: C26H53O4N
Smiles:
CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCHBA: | 5 | RingCount: | 0 |
HBD: | 4 | FractionCSP3: | 0.96 |
AlogP: | 5.64 | Num_rotatable_bonds: | 23 |
MolWt: | 443.71 | Num_heavy_atoms: | 31 |
TPSA: | 89.79 | NumAromaticRings: | 0 |