Paecilomycine B (CHEBI:198149)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Paecilomycine B

ChEBI ID	CHEBI:198149

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H22O5

Net Charge

Average Mass

282.336

Monoisotopic Mass

282.14672

InChI

InChI=1S/C15H22O5/c1-9-3-4-13-7-20-15(18)6-12(13,2)14(17,11(15)16)8-19-10(13)5-9/h5,10-11,16-18H,3-4,6-8H2,1-2H3/t10-,11-,12+,13+,14-,15+/m0/s1

InChIKey

JQCNBKRASCMEBM-JRULLXGZSA-N

SMILES

O1[C@@]2(O)[C@@H](O)[C@@]3(O)CO[C@@H]4[C@](C1)(CCC(=C4)C)[C@]3(C2)C

Metabolite of Species	Details
Cordyceps tenuipes (NCBI:txid45847)	See: DOI

ChEBI Ontology
Outgoing	Paecilomycine B (CHEBI:198149) is a oxacycle (CHEBI:38104)

IUPAC Name

(1R,4R,9S,12S,13R,15S)-7,13-dimethyl-2,10-dioxatetracyclo[10.2.1.04,9.04,13]pentadec-7-ene-1,12,15-triol