Glycoside
GD036014
Name:
NoneFormula:
C12H13O5N5Smiles:
C#C[C@@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21Aglycone:
Nc1nc2c(c(=O)[nH]1)N=C[N]2Sugarmoiety:
C#CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -2.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 307.27 | Num_heavy_atoms: | 22 |
| TPSA: | 159.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD00207
Formula: C5H4ON5
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.23 | NumAromaticRings: | 1 |
