Glycoside
GD021029
Name:
NoneFormula:
C20H21O5N6BrSmiles:
Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 505.33 | Num_heavy_atoms: | 32 |
| TPSA: | 164.56 | NumAromaticRings: | 4 |
Unique Aglycone
AD14430
Formula: C15H12ON6Br
Smiles:
Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 372.21 | Num_heavy_atoms: | 23 |
| TPSA: | 103.28 | NumAromaticRings: | 3 |
