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CHEBI:215246 - Bipolenin H

ChEBI IDCHEBI:215246
ChEBI NameBipolenin H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O4
Net Charge0
Average Mass308.418
Monoisotopic Mass308.19876
SMILESCC1=C(C=O)[C@@H]2C(COC(=O)C(C)O)[C@@]1(C)CC[C@@H]2C(C)C
InChIInChI=1S/C18H28O4/c1-10(2)13-6-7-18(5)11(3)14(8-19)16(13)15(18)9-22-17(21)12(4)20/h8,10,12-13,15-16,20H,6-7,9H2,1-5H3/t12?,13-,15?,16-,18+/m1/s1
InChIKeyVLOSVUYTOCZPTP-IMAOSDNASA-N
Species of MetaboliteComponentSourceComments
Bipolaris eleusines (ncbitaxon:91366) - DOI (10.1016/j.phytol.2018.07.007)
ChEBI Ontology
Outgoing Relation(s)
Bipolenin H (CHEBI:215246) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(1R,4R,5S)-6-ormyl-1,7-dimethyl-4-propan-2-yl-8-bicyclo[3.2.1]oct-6-enyl]methyl 2-hydroxypropanoate