(2R)-N-[(2R,3R,5R)-3,5-dihydroxy-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadecan-2-yl]-2-hydroxydocosanamide
AlkaPlorer ID: AK128234
Synonym: None
IUPAC Name: (2R)-N-[(2R,3R,5R)-3,5-dihydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadecan-2-yl]-2-hydroxydocosanamide
Structure
SMILES: CCCCCCCCCCCCCCCCCCCC[C@@H](O)C(O)=N[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)C[C@H](O)CCCCCCCCCCCCC
InChI: InChI=1S/C46H91NO10/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-29-31-33-39(50)45(55)47-38(36-56-46-44(54)43(53)42(52)41(35-48)57-46)40(51)34-37(49)32-30-28-26-24-22-14-12-10-8-6-4-2/h37-44,46,48-54H,3-36H2,1-2H3,(H,47,55)/t37-,38-,39-,40-,41-,42-,43+,44-,46-/m1/s1
InChIKey: ZHEPWRNJEWCQDK-PVRDAGOCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Liatris pycnostachya | Liatris | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Gomphrena macrocephala | Gomphrena | Amaranthaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 818.2309999999995
TPSA？: 192.66
MolLogP？: 8.733700000000011
Number of H-Donors: 8
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|