Glycoside
GD039576
Name:
methyl 6,8-dideoxy-6-{[(4r)-1-methyl-4-propyl-l-prolyl]amino}-1-thio-d-glycero-alpha-d-galacto-octopyranosid-7-uloseFormula:
C18H32O6N2SSmiles:
CCC[C@@H]1C[C@@H](C(=O)N[C@@H](C(C)=O)[C@H]2O[C@H](SC)[C@H](O)[C@H](O)[C@@H]2O)N(C)C1Aglycone:
CCCC1CC(C(=O)NCC(C)=O)N(C)C1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.89 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 404.53 | Num_heavy_atoms: | 27 |
| TPSA: | 119.33 | NumAromaticRings: | 0 |
Unique Aglycone
AD24460
Formula: C12H22O2N2
Smiles:
CCCC1CC(C(=O)NCC(C)=O)N(C)C1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 5 |
| MolWt: | 226.32 | Num_heavy_atoms: | 16 |
| TPSA: | 49.41 | NumAromaticRings: | 0 |
