Glycoside
GD103479
Name:
NoneFormula:
C19H32O4N7SSmiles:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OCAglycone:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 10 |
| MolWt: | 454.58 | Num_heavy_atoms: | 31 |
| TPSA: | 131.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD40200
Formula: C13H21N7S
Smiles:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 307.43 | Num_heavy_atoms: | 21 |
| TPSA: | 80.74 | NumAromaticRings: | 1 |
