Glycoside
GD068144
Name:
NoneFormula:
C14H22O7N2SSmiles:
COc1nc(C)c(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)s1Aglycone:
COc1nc(C)c(C(=O)NCCO)s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 6 |
| MolWt: | 362.4 | Num_heavy_atoms: | 24 |
| TPSA: | 130.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD32331
Formula: C8H12O3N2S
Smiles:
COc1nc(C)c(C(=O)NCCO)s1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 216.26 | Num_heavy_atoms: | 14 |
| TPSA: | 71.45 | NumAromaticRings: | 1 |
