Glycoside
GD076515
Name:
NoneFormula:
C14H16O4N8SSmiles:
C=CCn1nnnc1Sc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C=CCn1nnnc1Sc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 392.4 | Num_heavy_atoms: | 27 |
| TPSA: | 157.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD35272
Formula: C9H7N8S
Smiles:
C=CCn1nnnc1Sc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 259.28 | Num_heavy_atoms: | 18 |
| TPSA: | 95.84 | NumAromaticRings: | 2 |
