Glycoside
GD028550
Name:
4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acidFormula:
C12H14O6N4Smiles:
Nc1ncnc2c1c(C(=O)O)cn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(C(=O)O)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 310.27 | Num_heavy_atoms: | 22 |
| TPSA: | 163.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD01459
Formula: C7H5O2N4
Smiles:
Nc1ncnc2c1C(C(=O)O)=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 177.14 | Num_heavy_atoms: | 13 |
| TPSA: | 103.2 | NumAromaticRings: | 1 |
