Glycoside
GD075556
Name:
NoneFormula:
C15H23O7N3SSmiles:
O=S(=O)(c1ccnc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1)N1CCCC1Aglycone:
Nc1cc(S(=O)(=O)N2CCCC2)ccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.92 | Num_rotatable_bonds: | 5 |
| MolWt: | 389.43 | Num_heavy_atoms: | 26 |
| TPSA: | 152.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD35011
Formula: C9H13O2N3S
Smiles:
Nc1cc(S(=O)(=O)N2CCCC2)ccn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.29 | Num_heavy_atoms: | 15 |
| TPSA: | 76.29 | NumAromaticRings: | 1 |
