Glycoside
GD125684
Name:
DesulfoglucoberteroinFormula:
C13H25O6NS2Smiles:
CSCCCCCC(=NO)SC1OC(CO)C(O)C(O)C1OAglycone:
CSCCCCCC(S)=NOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 8 |
| MolWt: | 355.48 | Num_heavy_atoms: | 22 |
| TPSA: | 122.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD50839
Formula: C7H15ONS2
Smiles:
CSCCCCCC(S)=NO| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 193.34 | Num_heavy_atoms: | 11 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
