Glycoside
GD014723
Name:
NoneFormula:
C19H27O5N2ClSSmiles:
CCCc1ccnc(C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)c1Aglycone:
CCCc1ccnc(C(=O)NCC(C)Cl)c1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 418.94 | Num_heavy_atoms: | 27 |
| TPSA: | 111.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD10793
Formula: C13H17ON2Cl
Smiles:
CCCc1ccnc(C(=O)NCC(C)Cl)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 240.73 | Num_heavy_atoms: | 16 |
| TPSA: | 41.99 | NumAromaticRings: | 1 |
