Glycoside
GD089208
Name:
NoneFormula:
C20H28O7N4Smiles:
O=C(Nc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]c1=O)N[C@]12C[C@H]3C[C@H](C[C@H](C3)C1)C2Aglycone:
O=C(Nc1c[nH]c(=O)[nH]c1=O)NC12CC3CC(CC(C3)C1)C2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.75 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 436.47 | Num_heavy_atoms: | 31 |
| TPSA: | 165.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD38939
Formula: C15H20O3N4
Smiles:
O=C(Nc1c[nH]c(=O)[nH]c1=O)NC12CC3CC(CC(C3)C1)C2| HBA: | 7 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 304.35 | Num_heavy_atoms: | 22 |
| TPSA: | 106.85 | NumAromaticRings: | 1 |
