Glycoside
GD056186
Name:
NoneFormula:
C14H23O7N3Smiles:
COc1nn(C)cc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
COc1nn(C)cc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 6 |
| MolWt: | 345.35 | Num_heavy_atoms: | 24 |
| TPSA: | 135.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD28257
Formula: C8H13O3N3
Smiles:
COc1nn(C)cc1C(=O)NCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 199.21 | Num_heavy_atoms: | 14 |
| TPSA: | 76.38 | NumAromaticRings: | 1 |
