Glycoside
GD139410
Name:
NoneFormula:
C15H26O10N2SSmiles:
CSCC(N=C(O)CCC(NCC1(O)OCC(O)C(O)C1O)C(=O)O)C(=O)OAglycone:
CNC(CCC(O)=NC(CSC)C(=O)O)C(=O)OSugarmoiety:
OC1COC(O)(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.8 |
| AlogP: | -2.62 | Num_rotatable_bonds: | 11 |
| MolWt: | 426.44 | Num_heavy_atoms: | 28 |
| TPSA: | 209.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD56212
Formula: C10H18O5N2S
Smiles:
CNC(CCC(O)=NC(CSC)C(=O)O)C(=O)O| HBA: | 7 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 9 |
| MolWt: | 278.33 | Num_heavy_atoms: | 18 |
| TPSA: | 119.22 | NumAromaticRings: | 0 |
