Glycoside
GD083406
Name:
NoneFormula:
C15H21O5N5S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(NS(=O)(=O)CC4CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(CC1CC1)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 415.5 | Num_heavy_atoms: | 27 |
| TPSA: | 139.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD33776
Formula: C9H10O2N5S
Smiles:
O=S(=O)(CC1CC1)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 252.28 | Num_heavy_atoms: | 17 |
| TPSA: | 98.41 | NumAromaticRings: | 1 |
