Glycoside
GD090071
Name:
NoneFormula:
C17H22O7N4SSmiles:
Cc1cccc(C)c1S(=O)(=O)Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1cccc(C)c1S(=O)(=O)NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 6 |
| MolWt: | 426.45 | Num_heavy_atoms: | 29 |
| TPSA: | 177.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD39180
Formula: C12H13O3N4S
Smiles:
Cc1cccc(C)c1S(=O)(=O)NC1=C(C(N)=O)N=C[N]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 293.33 | Num_heavy_atoms: | 20 |
| TPSA: | 115.72 | NumAromaticRings: | 1 |
