Glycoside
GD091652
Name:
NoneFormula:
C18H27O6N5SSmiles:
CSC[C@H]1O[C@@H](n2cnc3c(NC[C@H](O)C(=O)OC(C)(C)C)ncnc32)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)C(O)CNc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 441.51 | Num_heavy_atoms: | 30 |
| TPSA: | 151.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD39981
Formula: C12H16O3N5
Smiles:
CC(C)(C)OC(=O)C(O)CNc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 278.29 | Num_heavy_atoms: | 20 |
| TPSA: | 110.8 | NumAromaticRings: | 1 |
