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CHEBI:88023 - α-mycolate type-3 (V')

ChEBI IDCHEBI:88023
ChEBI Nameα-mycolate type-3 (V')
Stars
ASCII Namealpha-mycolate type-3 (V')
DefinitionThe conjugate base of α-mycolic acid type-3 (V'). A class of mycolic acids characterized by the presence of a proximal cis-cyclopropyl group followed by a cis C=C double bond and another distal cis-cyclopropyl group in the meromycolic chain.
Submitternhn
DownloadsMolfile
Formula(CH2)l.(CH2)m.(CH2)n.(CH2)p.(CH2)q.C13H19O3
Net Charge-1
Average Mass293.427
Monoisotopic Mass293.21222
SMILESCCC1CC1C/C=C\CC1CC1C[C@@H](O)[C@@H](CC)C(=O)[O-]
InChIInChI=1S/C18H30O3/c1-3-12-9-13(12)7-5-6-8-14-10-15(14)11-17(19)16(4-2)18(20)21/h5-6,12-17,19H,3-4,7-11H2,1-2H3,(H,20,21)/p-1/b6-5-/t12?,13?,14?,15?,16-,17-/m1/s1
InChIKeyIAPDOQWBIGLMRU-WHCHVSLJSA-M
ChEBI Ontology
Outgoing Relation(s)
α-mycolate type-3 (V') (CHEBI:88023) is a mycolate (CHEBI:25436)
UniProt Name  Source
(Z,Z)-dicyclopropyl-(Z)-Δ-α-mycolateUniProt
Citations