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CHEBI:88034 - ketomycolate type-1 (X)

ChEBI IDCHEBI:88034
ChEBI Nameketomycolate type-1 (X)
Stars
DefinitionThe conjugate base of ketomycolic acid type-1 (X). A class of mycolic acids characterized by the presence of a proximal cis-cyclopropyl group followed by a distal oxo group and a (CH-CH3) fragment of (S) stereochemistry in the meromycolic chain.
Submitternhn
DownloadsMolfile
Formula(CH2)l.(CH2)m.(CH2)n.(CH2)p.C11H17O4
Net Charge-1
Average Mass269.361
Monoisotopic Mass269.17583
SMILESCC[C@H](C)C(=O)CC1CC1C[C@@H](O)[C@@H](CC)C(=O)[O-]
InChIInChI=1S/C15H26O4/c1-4-9(3)13(16)7-10-6-11(10)8-14(17)12(5-2)15(18)19/h9-12,14,17H,4-8H2,1-3H3,(H,18,19)/p-1/t9-,10?,11?,12+,14+/m0/s1
InChIKeyBGVSTANWOSTOBB-WTLXEASNSA-M
ChEBI Ontology
Outgoing Relation(s)
ketomycolate type-1 (X) (CHEBI:88034) is a mycolate (CHEBI:25436)
Synonyms  Source
(Z)-cyclopropyl-oxomycolateSUBMITTER
cis ketomycolateSUBMITTER
Citations