Glycoside
GD102410
Name:
NoneFormula:
C15H20O6N5ISmiles:
CC[C@@H](C)OC(=O)Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCC(C)OC(=O)Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 493.26 | Num_heavy_atoms: | 27 |
| TPSA: | 151.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD43343
Formula: C10H11O2N5I
Smiles:
CCC(C)OC(=O)Nc1nc(I)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 360.14 | Num_heavy_atoms: | 18 |
| TPSA: | 90.57 | NumAromaticRings: | 1 |
