Glycoside
GD025367
Name:
NoneFormula:
C14H24O8N3PSmiles:
CCOP(=O)(C[C@H](O)[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@H](O)[C@H]1O)OCCAglycone:
CCOP(=O)(CCO)OCC.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 8 |
| MolWt: | 393.33 | Num_heavy_atoms: | 26 |
| TPSA: | 166.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD00115
Formula: C4H5ON3
Smiles:
Nc1cc[nH]c(=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.1 | Num_heavy_atoms: | 8 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
AD02338
Formula: C6H15O4P
Smiles:
CCOP(=O)(CCO)OCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 182.16 | Num_heavy_atoms: | 11 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
