Glycoside
GD069333
Name:
NoneFormula:
C16H21O5N3SSmiles:
Cc1nc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c2c3c(sc2n1)CCC3Aglycone:
Cc1nc(N)c2c3c(sc2n1)CCC3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 367.43 | Num_heavy_atoms: | 25 |
| TPSA: | 127.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD32907
Formula: C10H11N3S
Smiles:
Cc1nc(N)c2c3c(sc2n1)CCC3| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 0 |
| MolWt: | 205.29 | Num_heavy_atoms: | 14 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
