Glycoside
GD084495
Name:
NoneFormula:
C19H25O7N3Smiles:
COc1ccc(-n2cc(C(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)cn2)cc1Aglycone:
COc1ccc(-n2cc(C(=O)NCCO)cn2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 7 |
| MolWt: | 407.42 | Num_heavy_atoms: | 29 |
| TPSA: | 135.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD37740
Formula: C13H15O3N3
Smiles:
COc1ccc(-n2cc(C(=O)NCCO)cn2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.23 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 261.28 | Num_heavy_atoms: | 19 |
| TPSA: | 76.38 | NumAromaticRings: | 2 |
