Glycoside
GD091303
Name:
NoneFormula:
C16H21O5N5S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(N=C4CCS(=O)(=O)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
O=S1(=O)CCC(=Nc2ncnc3c2N=C[N]3)CC1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 427.51 | Num_heavy_atoms: | 28 |
| TPSA: | 139.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD39828
Formula: C10H10O2N5S
Smiles:
O=S1(=O)CCC(=Nc2ncnc3c2N=C[N]3)CC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 264.29 | Num_heavy_atoms: | 18 |
| TPSA: | 98.74 | NumAromaticRings: | 1 |
