Glycoside
GD016888
Name:
NoneFormula:
C18H28O10N3PS2Smiles:
CCOP(=S)(NN1C(=O)CSC1=N[C@@H]1OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)OCCAglycone:
CCOP(=S)(NN1C(=N)SCC1=O)OCCSugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.72 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 10 |
| MolWt: | 541.54 | Num_heavy_atoms: | 34 |
| TPSA: | 151.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD12106
Formula: C7H14O3N3PS2
Smiles:
CCOP(=S)(NN1C(=N)SCC1=O)OCC| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 283.32 | Num_heavy_atoms: | 16 |
| TPSA: | 74.65 | NumAromaticRings: | 0 |
