Glycoside
GD144280
Name:
Fr901463Formula:
C28H42O8NClSmiles:
CC(=O)OC(C)C=CC(O)=NC1CC(C)C(CC=C(C)C=CC2OC(C)(O)CC(O)(CCl)C2O)OC1CAglycone:
C=CC(C)=CCC1OC(C)C(N=C(O)C=CC(C)OC(C)=O)CC1CSugarmoiety:
CC1(O)CC(O)(CCl)C(O)C(O)O1Other Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 3.35 | Num_rotatable_bonds: | 9 |
| MolWt: | 544.09 | Num_heavy_atoms: | 37 |
| TPSA: | 138.04 | NumAromaticRings: | 0 |
Unique Aglycone
AD48230
Formula: C20H31O4N
Smiles:
C=CC(C)=CCC1OC(C)C(N=C(O)C=CC(C)OC(C)=O)CC1C| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 4.16 | Num_rotatable_bonds: | 7 |
| MolWt: | 349.47 | Num_heavy_atoms: | 25 |
| TPSA: | 68.12 | NumAromaticRings: | 0 |
