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CHEBI:215126 - Rubetaulanobiline B

ChEBI IDCHEBI:215126
ChEBI NameRubetaulanobiline B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESC[C@H]1[C@@H](O)C2=C(C=C3CC(C)(C)C[C@@H]31)C(=O)OC2
InChIInChI=1S/C15H20O3/c1-8-11-6-15(2,3)5-9(11)4-10-12(13(8)16)7-18-14(10)17/h4,8,11,13,16H,5-7H2,1-3H3/t8-,11-,13-/m1/s1
InChIKeyJODSFOCIMNCOQW-XTWCZFFVSA-N
Species of MetaboliteComponentSourceComments
Russula nobilis (ncbitaxon:2830151) - PubMed (25246151)
ChEBI Ontology
Outgoing Relation(s)
Rubetaulanobiline B (CHEBI:215126) is a butenolide (CHEBI:50523)
IUPAC Name 
(4R,5R,5aR)-4-hydroxy-5,7,7-trimethyl-3,4,5,5a,6,8-hexahydroazuleno[5,6-c]uran-1-one
Manual XrefsDatabases
78442044ChemSpider