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CHEBI:88018 - α-mycolate type-2 (III)

ChEBI IDCHEBI:88018
ChEBI Nameα-mycolate type-2 (III)
Stars
ASCII Namealpha-mycolate type-2 (III)
DefinitionThe conjugate base of α-mycolic acid type-2 (III). A class of mycolic acids characterized by the presence of a proximal alkenyl group with a trans C=C double bond and a distal cis-cyclopropyl group in the meromycolic chain.
Submitternhn
DownloadsMolfile
Formula(CH2)l.(CH2)m.(CH2)n.(CH2)p.C12H19O3
Net Charge-1
Average Mass267.389
Monoisotopic Mass267.19657
SMILESCCC1CC1C/C=C/C(C)C[C@@H](O)[C@@H](CC)C(=O)[O-]
InChIInChI=1S/C16H28O3/c1-4-12-10-13(12)8-6-7-11(3)9-15(17)14(5-2)16(18)19/h6-7,11-15,17H,4-5,8-10H2,1-3H3,(H,18,19)/p-1/b7-6+/t11?,12?,13?,14-,15-/m1/s1
InChIKeyUOVDGJNFMGRSHT-ANAXHVIOSA-M
ChEBI Ontology
Outgoing Relation(s)
α-mycolate type-2 (III) (CHEBI:88018) is a an α-mycolate (CHEBI:87903)
UniProt Name  Source
(E)-Δ-(Z)-cyclopropyl-α-mycolateUniProt
Citations