Glycoside
GD095252
Name:
NoneFormula:
C19H31O8N5Smiles:
CCn1nnc2c1[C@@H](C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)CN(C(=O)OC(C)(C)C)C2Aglycone:
CCn1nnc2c1C(C(N)=O)CN(C(=O)OC(C)(C)C)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 457.48 | Num_heavy_atoms: | 32 |
| TPSA: | 179.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD40651
Formula: C13H21O3N5
Smiles:
CCn1nnc2c1C(C(N)=O)CN(C(=O)OC(C)(C)C)C2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.69 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 295.34 | Num_heavy_atoms: | 21 |
| TPSA: | 103.34 | NumAromaticRings: | 1 |
