Glycoside
GD002881
Name:
NoneFormula:
C11H15O4N3Smiles:
C=Cc1cn([C@@H]2O[C@H](C)[C@H](O)[C@H]2O)c(=O)nc1NAglycone:
C=Cc1c[nH]c(=O)nc1NSugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 253.26 | Num_heavy_atoms: | 18 |
| TPSA: | 110.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD02693
Formula: C6H7ON3
Smiles:
C=Cc1c[nH]c(=O)nc1N| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 1 |
| MolWt: | 137.14 | Num_heavy_atoms: | 10 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
