Glycoside
GD078328
Name:
NoneFormula:
C16H21O4N5SSmiles:
CSC[C@H]1O[C@@H](n2cnc3c(N=C4CCOCC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N=C2CCOCC2)[N]1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 379.44 | Num_heavy_atoms: | 26 |
| TPSA: | 114.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD29960
Formula: C10H10ON5
Smiles:
C1=Nc2c(ncnc2N=C2CCOCC2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.22 | Num_heavy_atoms: | 16 |
| TPSA: | 73.83 | NumAromaticRings: | 1 |
