Glycoside
GD138829
Name:
Aestivophoenin CFormula:
C29H36O6N2Smiles:
CC(C)=CCc1cccc2c1Nc1c(C(=O)OC3OC(C)C(O)C(O)C3O)cccc1N2CC=C(C)CAglycone:
CC(C)=CCc1cccc2c1Nc1c(C(=O)O)cccc1N2CC=C(C)CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 4.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 508.62 | Num_heavy_atoms: | 37 |
| TPSA: | 111.49 | NumAromaticRings: | 2 |
Unique Aglycone
AD56010
Formula: C23H26O2N2
Smiles:
CC(C)=CCc1cccc2c1Nc1c(C(=O)O)cccc1N2CC=C(C)C| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.26 |
| AlogP: | 6.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 362.47 | Num_heavy_atoms: | 27 |
| TPSA: | 52.57 | NumAromaticRings: | 2 |
