Glycoside
GD097082
Name:
NoneFormula:
C20H26O8N4SSmiles:
CC1(C)CCc2cc(S(=O)(=O)Nc3c(C(N)=O)ncn3[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc2O1Aglycone:
CC1(C)CCc2cc(S(=O)(=O)NC3=C(C(N)=O)N=C[N]3)ccc2O1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 482.52 | Num_heavy_atoms: | 33 |
| TPSA: | 186.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD41265
Formula: C15H17O4N4S
Smiles:
CC1(C)CCc2cc(S(=O)(=O)NC3=C(C(N)=O)N=C[N]3)ccc2O1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 349.39 | Num_heavy_atoms: | 24 |
| TPSA: | 124.95 | NumAromaticRings: | 1 |
