Glycoside
GD049257
Name:
NoneFormula:
C12H19O6N3Smiles:
CC1(c2cn(C[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)nn2)COC1Aglycone:
Cn1cc(C2(C)COC2)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | -2.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 301.3 | Num_heavy_atoms: | 21 |
| TPSA: | 130.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD26113
Formula: C7H11ON3
Smiles:
Cn1cc(C2(C)COC2)nn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.71 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 1 |
| MolWt: | 153.19 | Num_heavy_atoms: | 11 |
| TPSA: | 39.94 | NumAromaticRings: | 1 |
