Glycoside
GD013850
Name:
NoneFormula:
C29H54O12N3SSmiles:
CCCCCCCCCCCCCCNC(=O)C(CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCC(=O)NCCS(=O)(=O)[O-]Aglycone:
CCCCCCCCCCCCCCNC(=O)C(CO)NC(=O)CCC(=O)NCCS(=O)(=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.9 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 25 |
| MolWt: | 668.83 | Num_heavy_atoms: | 45 |
| TPSA: | 243.88 | NumAromaticRings: | 0 |
Unique Aglycone
AD10272
Formula: C23H44O7N3S
Smiles:
CCCCCCCCCCCCCCNC(=O)C(CO)NC(=O)CCC(=O)NCCS(=O)(=O)[O-]| HBA: | 10 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 22 |
| MolWt: | 506.69 | Num_heavy_atoms: | 34 |
| TPSA: | 164.73 | NumAromaticRings: | 0 |
