Glycoside
GD070383
Name:
NoneFormula:
C17H23O4N5Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N=C3CCCCC3)ncnc21Aglycone:
C1=Nc2c(ncnc2N=C2CCCCC2)[N]1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.65 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.4 | Num_heavy_atoms: | 26 |
| TPSA: | 114.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD33343
Formula: C11H12N5
Smiles:
C1=Nc2c(ncnc2N=C2CCCCC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.45 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 1 |
| MolWt: | 214.25 | Num_heavy_atoms: | 16 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
