Glycoside
GD027508
Name:
NoneFormula:
C20H33O8N4PSmiles:
CCCCCCCCCCc1nc(O)c2ncn(C3O[C@H](COP(=O)(O)O)[C@H](O)[C@H]3O)c2n1Aglycone:
CCCCCCCCCCc1nc(O)c2c(n1)[N]C=N2.COP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 13 |
| MolWt: | 488.48 | Num_heavy_atoms: | 33 |
| TPSA: | 180.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD18077
Formula: C15H23ON4
Smiles:
CCCCCCCCCCc1nc(O)c2c(n1)[N]C=N2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 3.77 | Num_rotatable_bonds: | 9 |
| MolWt: | 275.38 | Num_heavy_atoms: | 20 |
| TPSA: | 72.47 | NumAromaticRings: | 1 |
