Glycoside
GD013598
Name:
NoneFormula:
C13H14O4N5ClSmiles:
C=C[C@@H]1O[C@H](n2cnc3c(NOC)nc(Cl)nc32)[C@H](O)[C@H]1OAglycone:
CONc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
C=CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 327.73 | Num_heavy_atoms: | 22 |
| TPSA: | 114.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD04988
Formula: C7H5ON5Cl
Smiles:
CONc1nc(Cl)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 198.59 | Num_heavy_atoms: | 13 |
| TPSA: | 73.5 | NumAromaticRings: | 1 |
