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CHEBI:225641 - Benwamycin B

ChEBI IDCHEBI:225641
ChEBI NameBenwamycin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26O3
Net Charge0
Average Mass278.392
Monoisotopic Mass278.18819
SMILESCc1ccc([C@H](C)[C@@H](O)[C@H](C)[C@H](C)O)c(/C=C/CO)c1
InChIInChI=1S/C17H26O3/c1-11-7-8-16(15(10-11)6-5-9-18)13(3)17(20)12(2)14(4)19/h5-8,10,12-14,17-20H,9H2,1-4H3/b6-5+/t12-,13+,14+,17+/m1/s1
InChIKeyXUDPSDWBKFBGHF-JOPHYIFZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31904958)
ChEBI Ontology
Outgoing Relation(s)
Benwamycin B (CHEBI:225641) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(2S,3R,4R,5S)-5-[2-[(E)-3-hydroxyprop-1-enyl]-4-methylphenyl]-3-methylhexane-2,4-diol
Manual XrefsDatabases
128440408ChemSpider