Glycoside
GD011900
Name:
NoneFormula:
C17H27O9N7Smiles:
CN(N=C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
C=NN(C)c1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC(O)C(O)C(O)C(O)O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.65 |
| AlogP: | -5.12 | Num_rotatable_bonds: | 9 |
| MolWt: | 473.44 | Num_heavy_atoms: | 33 |
| TPSA: | 256.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD09023
Formula: C7H8N7
Smiles:
C=NN(C)c1nc(N)c2c(n1)[N]C=N2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 190.19 | Num_heavy_atoms: | 14 |
| TPSA: | 93.86 | NumAromaticRings: | 1 |
