Glycoside
GD103642
Name:
NoneFormula:
C22H28O5N6SSmiles:
CSCCC(=O)N(CCc1ccc(N)cc1)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CSCCC(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 9 |
| MolWt: | 488.57 | Num_heavy_atoms: | 34 |
| TPSA: | 159.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD43844
Formula: C17H19ON6S
Smiles:
CSCCC(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 355.45 | Num_heavy_atoms: | 25 |
| TPSA: | 98.57 | NumAromaticRings: | 2 |
