Glycoside
GD071987
Name:
NoneFormula:
C13H22O7N4SSmiles:
CC[C@@H](C)S(=O)(=O)Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCC(C)S(=O)(=O)NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -1.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 378.41 | Num_heavy_atoms: | 25 |
| TPSA: | 177.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD33761
Formula: C8H13O3N4S
Smiles:
CCC(C)S(=O)(=O)NC1=C(C(N)=O)N=C[N]1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 245.28 | Num_heavy_atoms: | 16 |
| TPSA: | 115.72 | NumAromaticRings: | 0 |
