Glycoside
GD077122
Name:
NoneFormula:
C15H17O4N7SSmiles:
OC[C@H]1O[C@@H](n2cnc3c(Sc4n[nH]c(C5CC5)n4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2Sc2n[nH]c(C3CC3)n2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 391.41 | Num_heavy_atoms: | 27 |
| TPSA: | 155.09 | NumAromaticRings: | 3 |
Unique Aglycone
AD35427
Formula: C10H8N7S
Smiles:
C1=Nc2c(ncnc2Sc2n[nH]c(C3CC3)n2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.29 | Num_heavy_atoms: | 18 |
| TPSA: | 93.81 | NumAromaticRings: | 2 |
