Glycoside
GD001156
Name:
NoneFormula:
C21H25O10N4PSmiles:
COC(=O)[C@H](Cc1c[nH]c2ccccc12)OP(=O)(O)OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@H](O)[C@H]1OAglycone:
COC(=O)C(Cc1c[nH]c2ccccc12)OP(=O)(O)OC.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 9 |
| MolWt: | 524.42 | Num_heavy_atoms: | 36 |
| TPSA: | 208.45 | NumAromaticRings: | 3 |
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 |
AD01204
Formula: C13H16O6NP
Smiles:
COC(=O)C(Cc1c[nH]c2ccccc12)OP(=O)(O)OC| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 313.25 | Num_heavy_atoms: | 21 |
| TPSA: | 97.85 | NumAromaticRings: | 2 |
