Glycoside
GD084517
Name:
NoneFormula:
C18H24O7N2SSmiles:
Cc1cnc2c(S(=O)(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)cccc2c1Aglycone:
Cc1cnc2c(S(=O)(=O)NCCO)cccc2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 6 |
| MolWt: | 412.46 | Num_heavy_atoms: | 28 |
| TPSA: | 138.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD37755
Formula: C12H14O3N2S
Smiles:
Cc1cnc2c(S(=O)(=O)NCCO)cccc2c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 4 |
| MolWt: | 266.32 | Num_heavy_atoms: | 18 |
| TPSA: | 79.29 | NumAromaticRings: | 2 |
