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CHEBI:213005 - Cupreal

ChEBI IDCHEBI:213005
ChEBI NameCupreal
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26O2
Net Charge0
Average Mass250.382
Monoisotopic Mass250.19328
SMILESC[C@H]1[C@@H]2CC(C)(C)C[C@@H]2[C@@]2(C)C[C@@]2(C=O)[C@H]1CO
InChIInChI=1S/C16H26O2/c1-10-11-5-14(2,3)6-12(11)15(4)8-16(15,9-18)13(10)7-17/h9-13,17H,5-8H2,1-4H3/t10-,11-,12-,13-,15+,16+/m0/s1
InChIKeyOQGRKMOEWMSLFR-OBPPPDSMSA-N
Species of MetaboliteComponentSourceComments
Russula cuprea (ncbitaxon:176790) - DOI (10.1016/s0031-9422(97)00259-8)
ChEBI Ontology
Outgoing Relation(s)
Cupreal (CHEBI:213005) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1aR,2S,3S,3aS,6aS,6bR)-2-(hydroxymethyl)-3,5,5,6b-tetramethyl-2,3,3a,4,6,6a-hexahydro-1H-cyclopropa[e]indene-1a-carbaldehyde
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78437482ChemSpider