(2R)-N-[(2S,3S,4R,6E)-1-{[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydroxyoctadec-6-en-2-yl]-2-hydroxydocosanamide
AlkaPlorer ID: AK093280
Synonym: None
IUPAC Name: (2R)-N-[(E,2S,3S,4R)-1-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxyoctadec-6-en-2-yl]-2-hydroxydocosanamide
Structure
SMILES: CCCCCCCCCCC/C=C/C[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1N=C(C)O)N=C(O)[C@H](O)CCCCCCCCCCCCCCCCCCCC
InChI: InChI=1S/C48H92N2O10/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-33-35-41(54)47(58)50-39(37-59-48-43(49-38(3)52)46(57)45(56)42(36-51)60-48)44(55)40(53)34-32-30-28-26-24-17-15-13-11-9-7-5-2/h30,32,39-46,48,51,53-57H,4-29,31,33-37H2,1-3H3,(H,49,52)(H,50,58)/b32-30+/t39-,40+,41+,42+,43+,44-,45+,46+,48+/m0/s1
InChIKey: WBTIQEFPWJUGBJ-GMYYZAQESA-N
Reference
Amphiceramide A and B, Novel Glycosphingolipids from the Marine Sponge <i>Amphimedon compressa</i>
PubChem CID: 42637545
LOTUS: LTS0011752
SuperNatural Ⅲ: SN0406033-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amphimedon compressa | Amphimedon | Niphatidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 857.2679999999989
TPSA？: 205.02
MolLogP？: 9.4938
Number of H-Donors: 8
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|