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CHEBI:205654 - Halymecin B

ChEBI IDCHEBI:205654
ChEBI NameHalymecin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H86O19
Net Charge0
Average Mass967.197
Monoisotopic Mass966.57633
SMILESCCCCC[C@@H](O)C[C@H](CC(=O)O[C@H](CCCCC)C[C@@H](O)CC(=O)O[C@H](CCCCC)C[C@H](CC(=O)O[C@H](CCCCC)C[C@@H](O)CC(=O)O)OC(C)=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C48H86O19/c1-6-10-14-18-32(51)22-38(66-48-47(61)46(60)45(59)40(30-49)67-48)28-43(57)64-36(20-16-12-8-3)24-34(53)26-42(56)65-37(21-17-13-9-4)27-39(62-31(5)50)29-44(58)63-35(19-15-11-7-2)23-33(52)25-41(54)55/h32-40,45-49,51-53,59-61H,6-30H2,1-5H3,(H,54,55)/t32-,33-,34-,35-,36-,37-,38-,39-,40-,45-,46+,47+,48-/m1/s1
InChIKeyNOMDKESBADZKCR-WYFDDTMZSA-N
Species of MetaboliteComponentSourceComments
Fusarium (ncbitaxon:5506) - PubMed (8968393)
ChEBI Ontology
Outgoing Relation(s)
Halymecin B (CHEBI:205654) is a glycolipid (CHEBI:33563)
IUPAC Name 
(3R,5R)-5-[(3R,5R)-3-acetyloxy-5-[(3R,5R)-3-hydroxy-5-[(3R,5R)-5-hydroxy-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydecanoyl]oxydecanoyl]oxydecanoyl]oxy-3-hydroxydecanoic acid
Manual XrefsDatabases
8828849ChemSpider