Glycoside
GD047029
Name:
NoneFormula:
C12H17O5N5Smiles:
COc1nc(N)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@]1(C)OAglycone:
COc1nc(N)nc2c1N=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.3 | Num_heavy_atoms: | 22 |
| TPSA: | 148.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD01261
Formula: C6H6ON5
Smiles:
COc1nc(N)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.15 | Num_heavy_atoms: | 12 |
| TPSA: | 87.49 | NumAromaticRings: | 1 |
