Glycoside
GD098208
Name:
NoneFormula:
C17H19O6N5S2Smiles:
O=S(=O)(Cc1ccccc1)Nc1[nH]c(=S)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=S(=O)(Cc1ccccc1)Nc1[nH]c(=S)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 453.5 | Num_heavy_atoms: | 30 |
| TPSA: | 162.59 | NumAromaticRings: | 3 |
Unique Aglycone
AD41787
Formula: C12H10O2N5S2
Smiles:
O=S(=O)(Cc1ccccc1)Nc1[nH]c(=S)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 320.38 | Num_heavy_atoms: | 21 |
| TPSA: | 101.31 | NumAromaticRings: | 2 |
