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CHEBI:223899 - Rhinomilisin B

ChEBI IDCHEBI:223899
ChEBI NameRhinomilisin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H23ClO6
Net Charge0
Average Mass334.796
Monoisotopic Mass334.11832
SMILESCC(C)[C@H]1CC[C@@](O)(CCl)[C@@H](C(=O)O)[C@@H]1/C=C(\CO)C(=O)O
InChIInChI=1S/C15H23ClO6/c1-8(2)10-3-4-15(22,7-16)12(14(20)21)11(10)5-9(6-17)13(18)19/h5,8,10-12,17,22H,3-4,6-7H2,1-2H3,(H,18,19)(H,20,21)/b9-5+/t10-,11-,12-,15-/m1/s1
InChIKeyXDRASELQBRTOKW-HXYHFMIISA-N
Species of MetaboliteComponentSourceComments
Rhinocladiella similis (ncbitaxon:319420) - PubMed (31044595)
ChEBI Ontology
Outgoing Relation(s)
Rhinomilisin B (CHEBI:223899) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,2S,5R,6S)-6-[(E)-2-carboxy-3-hydroxyprop-1-enyl]-2-(chloromethyl)-2-hydroxy-5-propan-2-ylcyclohexane-1-carboxylic acid
Manual XrefsDatabases
74832027ChemSpider