Glycoside
GD012903
Name:
NoneFormula:
C11H14O4N5ISmiles:
Cn1c(=O)[nH]c2c(ncn2C2O[C@H](CI)[C@H](O)[C@H]2O)c1=NAglycone:
Cn1c(=O)[nH]c2c(c1=N)N=C[N]2Sugarmoiety:
OC1OC(CI)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 407.17 | Num_heavy_atoms: | 21 |
| TPSA: | 129.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD01073
Formula: C6H6ON5
Smiles:
Cn1c(=O)[nH]c2c(c1=N)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 0 |
| MolWt: | 164.15 | Num_heavy_atoms: | 12 |
| TPSA: | 88.1 | NumAromaticRings: | 1 |
