Glycoside
GD009996
Name:
NoneFormula:
C18H31O6N3S2Smiles:
CCCCCCCCCC(=O)Nc1nnc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1Aglycone:
CCCCCCCCCC(=O)Nc1nnc(S)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.83 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 12 |
| MolWt: | 449.6 | Num_heavy_atoms: | 29 |
| TPSA: | 145.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD07776
Formula: C12H21ON3S2
Smiles:
CCCCCCCCCC(=O)Nc1nnc(S)s1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 3.91 | Num_rotatable_bonds: | 9 |
| MolWt: | 287.45 | Num_heavy_atoms: | 18 |
| TPSA: | 54.88 | NumAromaticRings: | 1 |
