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CHEBI:216605 - Cinatrin C1

ChEBI IDCHEBI:216605
ChEBI NameCinatrin C1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H30O8
Net Charge0
Average Mass374.430
Monoisotopic Mass374.19407
SMILESCCCCCCCCCCCC[C@]1(C(=O)O)OC(=O)[C@H](O)[C@]1(O)C(=O)O
InChIInChI=1S/C18H30O8/c1-2-3-4-5-6-7-8-9-10-11-12-17(15(21)22)18(25,16(23)24)13(19)14(20)26-17/h13,19,25H,2-12H2,1H3,(H,21,22)(H,23,24)/t13-,17+,18-/m0/s1
InChIKeyFDNNUUDWWYILJQ-VHSSKADRSA-N
Species of MetaboliteComponentSourceComments
Circinotrichum (ncbitaxon:1508298) - PubMed (1548188)
ChEBI Ontology
Outgoing Relation(s)
Cinatrin C1 (CHEBI:216605) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
(2S,3R,4R)-2-dodecyl-3,4-dihydroxy-5-oxooxolane-2,3-dicarboxylic acid
Manual XrefsDatabases
8627454ChemSpider