Glycoside
GD005634
Name:
NoneFormula:
C19H33O5N2ClSSmiles:
CS[C@@H]1O[C@H]([C@H](NC(=O)[C@@H]2NC[C@H]2CCC(C)C)[C@H](C)Cl)[C@H](O)[C@H](O)[C@H]1OAglycone:
CC(C)CCC1CNC1C(=O)NCC(C)ClSugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 8 |
| MolWt: | 424.99 | Num_heavy_atoms: | 27 |
| TPSA: | 111.05 | NumAromaticRings: | 0 |
Unique Aglycone
AD04758
Formula: C13H23ON2Cl
Smiles:
CC(C)CCC1CNC1C(=O)NCC(C)Cl| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.92 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 246.78 | Num_heavy_atoms: | 16 |
| TPSA: | 41.13 | NumAromaticRings: | 0 |
