Glycoside
GD100985
Name:
NoneFormula:
C16H22O6NISmiles:
Cc1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)ccc1IAglycone:
Cc1cc(C(=O)NCCO)ccc1ISugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 451.26 | Num_heavy_atoms: | 24 |
| TPSA: | 108.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD42683
Formula: C10H12O2NI
Smiles:
Cc1cc(C(=O)NCCO)ccc1I| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 305.12 | Num_heavy_atoms: | 14 |
| TPSA: | 49.33 | NumAromaticRings: | 1 |
