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CHEBI:68974 - squamostatin-D

ChEBI IDCHEBI:68974
ChEBI Namesquamostatin-D
Stars
DefinitionA natural product found in Annona squamosa.
Last Modified22 September 2014
DownloadsMolfile
FormulaC37H66O7
Net Charge0
Average Mass622.928
Monoisotopic Mass622.48085
SMILES[H][C@]1([C@H](O)CC[C@H](O)[C@]2([H])CC[C@@H](CCCCCCCCCC3=C[C@H](C)OC3=O)O2)CC[C@]([H])([C@@H](O)CCCCCCCCCC)O1
InChIInChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(38)35-25-26-36(44-35)33(40)23-22-32(39)34-24-21-30(43-34)19-16-13-10-8-9-12-15-18-29-27-28(2)42-37(29)41/h27-28,30-36,38-40H,3-26H2,1-2H3/t28-,30+,31-,32-,33+,34-,35+,36+/m0/s1
InChIKeyVZEPVAAWZDUQLP-FYHSANBVSA-N
Species of MetaboliteComponentSourceComments
Annona squamosa (ncbitaxon:301693) seed (BTO:0001226) PubMed (22011319) 95% ethanolic extract of seeds
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
squamostatin-D (CHEBI:68974) has role metabolite (CHEBI:25212)
squamostatin-D (CHEBI:68974) is a polyketide (CHEBI:26188)
Synonym  Source
(5S)-3-(9-{(2R,5S)-5-[(1S,4R)-1,4-Dihydroxy-4-{(2R,5R)-5-[(1S)-1-hydroxyundecyl]tetrahydro-2-furanyl}butyl]tetrahydro-2-furanyl}nonyl)-5-methyl-2(5H)-furanoneChEBI
Citations