Glycoside
GD156967
Name:
GlucorapheninFormula:
C12H21O10NS3Smiles:
CS(=O)C=CCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1OAglycone:
CS(=O)C=CCCC(S)=NOS(=O)(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 8 |
| MolWt: | 435.5 | Num_heavy_atoms: | 26 |
| TPSA: | 183.18 | NumAromaticRings: | 0 |
Unique Aglycone
AD62101
Formula: C6H11O5NS3
Smiles:
CS(=O)C=CCCC(S)=NOS(=O)(=O)O| HBA: | 6 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 273.36 | Num_heavy_atoms: | 15 |
| TPSA: | 93.03 | NumAromaticRings: | 0 |
