Glycoside
GD003916
Name:
NoneFormula:
C18H21O5N7Smiles:
COc1cccc(C=NNc2nc(N)c3ncn(C4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
COc1cccc(C=NNc2nc(N)c3c(n2)[N]C=N3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 415.41 | Num_heavy_atoms: | 30 |
| TPSA: | 173.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD03485
Formula: C13H12ON7
Smiles:
COc1cccc(C=NNc2nc(N)c3c(n2)[N]C=N3)c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 4 |
| MolWt: | 282.29 | Num_heavy_atoms: | 21 |
| TPSA: | 111.88 | NumAromaticRings: | 2 |
