Glycoside
GD097421
Name:
NoneFormula:
C21H26O9N2Smiles:
CCn1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c(=O)c2cc3c(cc21)OCO3Aglycone:
CCn1cc(C(=O)NCCO)c(=O)c2cc3c(cc21)OCO3Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 6 |
| MolWt: | 450.44 | Num_heavy_atoms: | 32 |
| TPSA: | 148.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD41429
Formula: C15H16O5N2
Smiles:
CCn1cc(C(=O)NCCO)c(=O)c2cc3c(cc21)OCO3| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 304.3 | Num_heavy_atoms: | 22 |
| TPSA: | 89.79 | NumAromaticRings: | 2 |
