Glycoside
GD050099
Name:
NoneFormula:
C14H22O6N2Smiles:
Cc1c[nH]cc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1c[nH]cc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 314.34 | Num_heavy_atoms: | 22 |
| TPSA: | 124.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD26494
Formula: C8H12O2N2
Smiles:
Cc1c[nH]cc1C(=O)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 168.2 | Num_heavy_atoms: | 12 |
| TPSA: | 65.12 | NumAromaticRings: | 1 |
