Glycoside
GD032894
Name:
NoneFormula:
C15H25O9N4PSmiles:
CC(C)C[C@H](NP(=O)(O)OC[C@@H]1OC(n2ccc(N)nc2=O)[C@H](O)[C@H]1O)C(=O)OAglycone:
COP(=O)(O)NC(CC(C)C)C(=O)O.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.67 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 9 |
| MolWt: | 436.36 | Num_heavy_atoms: | 29 |
| TPSA: | 206.46 | 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 |
AD21040
Formula: C7H16O5NP
Smiles:
COP(=O)(O)NC(CC(C)C)C(=O)O| HBA: | 6 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 225.18 | Num_heavy_atoms: | 14 |
| TPSA: | 95.86 | NumAromaticRings: | 0 |
