(2R)-N-[(2R,3R,5R)-3,5-dihydroxy-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}nonadecan-2-yl]-2-hydroxydocosanamide
AlkaPlorer ID: AK137351
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]oxynonadecan-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)CCCCCCCCCCCCCC
InChI: InChI=1S/C47H93NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-40(51)46(56)48-39(37-57-47-45(55)44(54)43(53)42(36-49)58-47)41(52)35-38(50)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h38-45,47,49-55H,3-37H2,1-2H3,(H,48,56)/t38-,39-,40-,41-,42-,43-,44+,45-,47-/m1/s1
InChIKey: BFVBMADDDRQDCR-VENYWMPBSA-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: 832.2579999999995
TPSA？: 192.66
MolLogP？: 9.123800000000008
Number of H-Donors: 8
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|