Mupirocin F (CHEBI:205355)

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CHEBI:205355 - Mupirocin F

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ChEBI ID	CHEBI:205355
ChEBI Name	Mupirocin F
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C26H42O9
Net Charge	0
Average Mass	498.613
Monoisotopic Mass	498.28288
SMILES	C/C(=C\C(=O)OCCCCCCCCC(=O)O)C[C@@H]1OC[C@H](C[C@@H]2O[C@H]2[C@@H](C)[C@H](C)O)C(=O)[C@H]1O
InChI	InChI=1S/C26H42O9/c1-16(13-23(30)33-11-9-7-5-4-6-8-10-22(28)29)12-20-25(32)24(31)19(15-34-20)14-21-26(35-21)17(2)18(3)27/h13,17-21,25-27,32H,4-12,14-15H2,1-3H3,(H,28,29)/b16-13+/t17-,18-,19-,20-,21-,25-,26-/m0/s1
InChIKey	KYBYRSYYFWFXDN-XVSJZSRMSA-N

Species of Metabolite	Component	Source	Comments
Pseudomonas fluorescens (ncbitaxon:294)	-	DOI (10.1016/j.tet.2011.05.021)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Mupirocin F (CHEBI:205355) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name
9-[(E)-4-[(2S,3S,5S)-3-hydroxy-5-[[(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl]methyl]-4-oxooxan-2-yl]-3-methylbut-2-enoyl]oxynonanoic acid

Manual Xrefs	Databases
28288855	ChemSpider