Glycoside
GD025410
Name:
NoneFormula:
C21H25O6N6SISmiles:
Nc1nc(SCCNC(=O)CCc2ccc(O)c(I)c2)nc2c1ncn2C1OC(CO)C(O)C1OAglycone:
Nc1nc(SCCNC(=O)CCc2ccc(O)c(I)c2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.43 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 9 |
| MolWt: | 616.44 | Num_heavy_atoms: | 35 |
| TPSA: | 188.87 | NumAromaticRings: | 3 |
Unique Aglycone
AD16853
Formula: C16H16O2N6SI
Smiles:
Nc1nc(SCCNC(=O)CCc2ccc(O)c(I)c2)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 483.32 | Num_heavy_atoms: | 26 |
| TPSA: | 127.59 | NumAromaticRings: | 2 |
