Glycoside
GD016789
Name:
NoneFormula:
C23H33O10N4PSmiles:
COCCCOC(=O)[C@H](C)NP(=O)(OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@@](C)(O)[C@H]1O)Oc1ccccc1Aglycone:
COCCCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1.Nc1cc[nH]c(=O)n1Sugarmoiety:
CC1(O)C(O)OC(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.52 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 13 |
| MolWt: | 556.51 | Num_heavy_atoms: | 38 |
| TPSA: | 193.69 | NumAromaticRings: | 2 |
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 |
AD12046
Formula: C14H22O6NP
Smiles:
COCCCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1| HBA: | 7 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 10 |
| MolWt: | 331.31 | Num_heavy_atoms: | 22 |
| TPSA: | 83.09 | NumAromaticRings: | 1 |
