Glycoside
GD028750
Name:
NoneFormula:
C22H42O6N2S3Smiles:
CCC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)SCCOCCS)[C@@H]2O[C@H](SC)[C@H](O)[C@H](O)[C@H]2O)N(C)C1Aglycone:
CCCC1CC(C(=O)NCC(C)SCCOCCS)N(C)C1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 13 |
| MolWt: | 526.79 | Num_heavy_atoms: | 33 |
| TPSA: | 111.49 | NumAromaticRings: | 0 |
Unique Aglycone
AD18751
Formula: C16H32O2N2S2
Smiles:
CCCC1CC(C(=O)NCC(C)SCCOCCS)N(C)C1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.94 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 11 |
| MolWt: | 348.58 | Num_heavy_atoms: | 22 |
| TPSA: | 41.57 | NumAromaticRings: | 0 |
