Glycoside
GD018337
Name:
NoneFormula:
C22H39O5N2ClSSmiles:
CCCCCC[C@@H]1CCN[C@H](C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)C1Aglycone:
CCCCCCC1CCNC(C(=O)NCC(C)Cl)C1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.95 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 10 |
| MolWt: | 467.07 | Num_heavy_atoms: | 30 |
| TPSA: | 111.05 | NumAromaticRings: | 0 |
Unique Aglycone
AD12955
Formula: C16H29ON2Cl
Smiles:
CCCCCCC1CCNC(C(=O)NCC(C)Cl)C1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.93 |
| AlogP: | 3.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 288.86 | Num_heavy_atoms: | 19 |
| TPSA: | 41.13 | NumAromaticRings: | 0 |
