Glycoside
GD141118
Name:
Salpichrolide KFormula:
C28H36O6Smiles:
CC(c1ccc2c(c1)CCC1C2CC2OC23CC=CC(=O)C13C)C1(O)CC(C)(O)C(C)(O)CO1Aglycone:
CCc1ccc2c(c1)CCC1C2CC2OC23CC=CC(=O)C13CSugarmoiety:
CC1(O)COC(O)(O)CC1(C)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.68 |
| AlogP: | 3.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 468.59 | Num_heavy_atoms: | 34 |
| TPSA: | 99.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD56873
Formula: C21H24O2
Smiles:
CCc1ccc2c(c1)CCC1C2CC2OC23CC=CC(=O)C13C| HBA: | 2 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.57 |
| AlogP: | 3.97 | Num_rotatable_bonds: | 1 |
| MolWt: | 308.42 | Num_heavy_atoms: | 23 |
| TPSA: | 29.6 | NumAromaticRings: | 1 |
