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CHEBI:221398 - 15G256ν

ChEBI IDCHEBI:221398
ChEBI Name15G256ν
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O9
Net Charge0
Average Mass384.381
Monoisotopic Mass384.14203
SMILESC[C@H](Cc1cc(O)cc(O)c1C(=O)O[C@H](C)CC(=O)O)OC(=O)C[C@@H](C)O
InChIInChI=1S/C18H24O9/c1-9(19)4-16(24)26-10(2)5-12-7-13(20)8-14(21)17(12)18(25)27-11(3)6-15(22)23/h7-11,19-21H,4-6H2,1-3H3,(H,22,23)/t9-,10-,11-/m1/s1
InChIKeyXLDHIOLFESHLLG-GMTAPVOTSA-N
Species of MetaboliteComponentSourceComments
Hypoxylon (ncbitaxon:42308) - DOI (10.1016/s0040-4020(02)00746-9)
ChEBI Ontology
Outgoing Relation(s)
15G256ν (CHEBI:221398) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
(3R)-3-[2,4-dihydroxy-6-[(2R)-2-[(3R)-3-hydroxybutanoyl]oxypropyl]benzoyl]oxybutanoic acid
Manual XrefsDatabases
10479417ChemSpider