Glycoside
GD005237
Name:
STRICTOSAMIDEFormula:
C26H30O9N2Smiles:
C=C[C@@H]1[C@@H]2C[C@@H]3c4[nH]c5ccccc5c4CCN3C(=O)C2=C(O)O[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
C=CC1C(O)OC(O)=C2C(=O)N3CCc4c([nH]c5ccccc45)C3CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 514.53 | Num_heavy_atoms: | 37 |
| TPSA: | 164.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD04477
Formula: C20H20O4N2
Smiles:
C=CC1C(O)OC(O)=C2C(=O)N3CCc4c([nH]c5ccccc45)C3CC21| HBA: | 6 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 352.39 | Num_heavy_atoms: | 26 |
| TPSA: | 85.79 | NumAromaticRings: | 2 |
