Glycoside
GD100949
Name:
NoneFormula:
C24H29O6N3Smiles:
Cc1ccc2nc(-c3ccccc3)c(CC(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)n2c1Aglycone:
Cc1ccc2nc(-c3ccccc3)c(CC(=O)NCCO)n2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 7 |
| MolWt: | 455.51 | Num_heavy_atoms: | 33 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD42663
Formula: C18H19O2N3
Smiles:
Cc1ccc2nc(-c3ccccc3)c(CC(=O)NCCO)n2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 309.37 | Num_heavy_atoms: | 23 |
| TPSA: | 66.63 | NumAromaticRings: | 3 |
