Glycoside
GD035869
Name:
NoneFormula:
C20H33O8N6PSmiles:
CC(=O)NCCCCCCCCNc1ncnc2c1ncn2C1O[C@H](COP(=O)(O)O)[C@H](O)[C@H]1OAglycone:
CC(=O)NCCCCCCCCNc1ncnc2c1N=C[N]2.COP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.7 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 14 |
| MolWt: | 516.49 | Num_heavy_atoms: | 35 |
| TPSA: | 201.18 | 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 |
AD01397
Formula: C15H23ON6
Smiles:
CC(=O)NCCCCCCCCNc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 10 |
| MolWt: | 303.39 | Num_heavy_atoms: | 22 |
| TPSA: | 93.37 | NumAromaticRings: | 1 |
