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CHEBI:226945 - Stereumin T

ChEBI IDCHEBI:226945
ChEBI NameStereumin T
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H36O5
Net Charge0
Average Mass392.536
Monoisotopic Mass392.25627
SMILESC=C1CO[C@]2(O)C[C@H](C)[C@H]3CC=C(C)[C@@H](OC(=O)CCCCCCC)[C@@H]3[C@]12O
InChIInChI=1S/C23H36O5/c1-5-6-7-8-9-10-19(24)28-21-15(2)11-12-18-16(3)13-22(25)23(26,20(18)21)17(4)14-27-22/h11,16,18,20-21,25-26H,4-10,12-14H2,1-3H3/t16-,18+,20+,21+,22+,23+/m0/s1
InChIKeyLERUJOXQLASWHV-QQBWQSCDSA-N
Species of MetaboliteComponentSourceComments
Stereum cf. sanguinolentum BCC 22926 (ncbitaxon:1513716) - PubMed (25004810)
ChEBI Ontology
Outgoing Relation(s)
Stereumin T (CHEBI:226945) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(3aR,5S,5aR,9S,9aR,9bS)-3a,9b-dihydroxy-5,8-dimethyl-1-methylidene-4,5,5a,6,9,9a-hexahydrobenzo[e][1]benzouran-9-yl] octanoate
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78442100ChemSpider