Glycoside
GD035610
Name:
NoneFormula:
C19H28O8N8SSmiles:
C[C@@H]1O[C@H](OCc2cn(S(=O)(=O)CCCCCn3cnc4c(=O)[nH]c(N)nc43)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Nc1nc2c(ncn2CCCCCS(=O)(=O)n2cc(CO)nn2)c(=O)[nH]1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.63 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 10 |
| MolWt: | 528.55 | Num_heavy_atoms: | 36 |
| TPSA: | 233.59 | NumAromaticRings: | 3 |
Unique Aglycone
AD22521
Formula: C13H18O4N8S
Smiles:
Nc1nc2c(ncn2CCCCCS(=O)(=O)n2cc(CO)nn2)c(=O)[nH]1| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 382.41 | Num_heavy_atoms: | 26 |
| TPSA: | 174.67 | NumAromaticRings: | 3 |
