Glycoside
GD143118
Name:
NoneFormula:
C29H40O13NSmiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)(O)C2O)C(C=C2CCCC2)C1C=CC1=CC(C(=O)O)=C[NH+](CCO)C1Aglycone:
COC(=O)C1=COC(O)C(C=C2CCCC2)C1C=CC1=CC(C(=O)O)=C[NH+](CCO)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.59 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 10 |
| MolWt: | 610.63 | Num_heavy_atoms: | 43 |
| TPSA: | 217.11 | NumAromaticRings: | 0 |
Unique Aglycone
AD57570
Formula: C23H30O7N
Smiles:
COC(=O)C1=COC(O)C(C=C2CCCC2)C1C=CC1=CC(C(=O)O)=C[NH+](CCO)C1| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 432.49 | Num_heavy_atoms: | 31 |
| TPSA: | 117.73 | NumAromaticRings: | 0 |
