Glycoside
GD072179
Name:
NoneFormula:
C13H22O8N4SSmiles:
CCOCCS(=O)(=O)Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOCCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -2.63 | Num_rotatable_bonds: | 9 |
| MolWt: | 394.41 | Num_heavy_atoms: | 26 |
| TPSA: | 186.23 | NumAromaticRings: | 1 |
Unique Aglycone
AD33768
Formula: C8H13O4N4S
Smiles:
CCOCCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 7 |
| MolWt: | 261.28 | Num_heavy_atoms: | 17 |
| TPSA: | 124.95 | NumAromaticRings: | 0 |
