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CHEBI:88025 - methoxymycolate type-1 (VI)

ChEBI IDCHEBI:88025
ChEBI Namemethoxymycolate type-1 (VI)
Stars
DefinitionThe conjugate base of methoxymycolic acid type-1 (VI). A class of mycolic acids characterized by the presence of a proximal cis-cyclopropyl group and a distal (CH-CH3)-(CHO-CH3) fragment of (S,S) stereochemistry in the meromycolic chain.
Submitternhn
DownloadsMolfile
Formula(CH2)l.(CH2)m.(CH2)n.(CH2)p.C12H21O4
Net Charge-1
Average Mass285.404
Monoisotopic Mass285.20713
SMILESCC[C@H](C)[C@H](CC1CC1C[C@@H](O)[C@@H](CC)C(=O)[O-])OC
InChIInChI=1S/C16H30O4/c1-5-10(3)15(20-4)9-12-7-11(12)8-14(17)13(6-2)16(18)19/h10-15,17H,5-9H2,1-4H3,(H,18,19)/p-1/t10-,11?,12?,13+,14+,15-/m0/s1
InChIKeyVHPWKMVQDALCMV-PTDAVJQHSA-M
ChEBI Ontology
Outgoing Relation(s)
methoxymycolate type-1 (VI) (CHEBI:88025) is a mycolate (CHEBI:25436)
Synonym  Source
(Z)-cyclopropyl-methoxymycolateSUBMITTER
UniProt Name  Source
(Z)-cyclopropyl-(S)-methoxy-(S)-methyl-α-mycolateUniProt
Citations