Glycoside
GD102708
Name:
NoneFormula:
C22H28O6N3ClSmiles:
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 7 |
| MolWt: | 453.92 | Num_heavy_atoms: | 31 |
| TPSA: | 126.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD43482
Formula: C16H18O2N3Cl
Smiles:
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NCCO| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 5 |
| MolWt: | 307.78 | Num_heavy_atoms: | 21 |
| TPSA: | 67.15 | NumAromaticRings: | 2 |
