Glycoside
GD032209
Name:
NoneFormula:
C18H16O5N4SSmiles:
OC[C@@H]1O[C@H](c2nc(-c3nc(-c4ccc5[nH]ccc5c4)no3)cs2)[C@H](O)[C@H]1OAglycone:
c1cc2cc(-c3noc(-c4cscn4)n3)ccc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 400.42 | Num_heavy_atoms: | 28 |
| TPSA: | 137.52 | NumAromaticRings: | 4 |
Unique Aglycone
AD20680
Formula: C13H8ON4S
Smiles:
c1cc2cc(-c3noc(-c4cscn4)n3)ccc2[nH]1| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.3 | Num_heavy_atoms: | 19 |
| TPSA: | 67.6 | NumAromaticRings: | 4 |
