Glycoside
GD068423
Name:
NoneFormula:
C15H23O4N5SSmiles:
CSC[C@H]1O[C@@H](n2cnc3c(NCC(C)(C)O)ncnc32)[C@H](O)[C@@H]1OAglycone:
CC(C)(O)CNc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 369.45 | Num_heavy_atoms: | 25 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD28662
Formula: C9H12ON5
Smiles:
CC(C)(O)CNc1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 206.23 | Num_heavy_atoms: | 15 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
