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CHEBI:191302 - Rhizochalinin D

ChEBI IDCHEBI:191302
ChEBI NameRhizochalinin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H70N2O8
Net Charge0
Average Mass646.951
Monoisotopic Mass646.51322
SMILESC[C@@H](N)[C@H](O)CCCCCCCCC(=O)CCCCCCCCCCCCCC[C@@H](O[C@@H]1O[C@H](CO)C(O)C(O)C1O)[C@@H](C)N
InChIInChI=1S/C35H70N2O8/c1-26(36)29(40)23-19-15-12-11-14-18-22-28(39)21-17-13-9-7-5-3-4-6-8-10-16-20-24-30(27(2)37)44-35-34(43)33(42)32(41)31(25-38)45-35/h26-27,29-35,38,40-43H,3-25,36-37H2,1-2H3/t26-,27-,29-,30-,31-,32?,33?,34?,35-/m1/s1
InChIKeyZOLNKPLWFFLILG-SWPKKLKXSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
ChEBI Ontology
Outgoing Relation(s)
Rhizochalinin D (CHEBI:191302) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
(2R,3R,27R,28R)-2,28-diamino-3-hydroxy-27-[(2R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonacosan-12-one
Manual XrefsDatabases
24823230ChemSpider
LMSP01080039LIPID MAPS