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CHEBI:215410 - Sterostrein T

ChEBI IDCHEBI:215410
ChEBI NameSterostrein T
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H34O5
Net Charge0
Average Mass474.597
Monoisotopic Mass474.24062
SMILESCOC1O[C@@]2(C)c3c(cc(C4=CC(=O)C5=CC(C)(C)C[C@@H]5[C@@]4(C)O)cc31)C(=O)C1=CC(C)(C)C[C@@H]12
InChIInChI=1S/C30H34O5/c1-27(2)11-18-21(13-27)29(5,33)20(10-23(18)31)15-8-16-24-17(9-15)26(34-7)35-30(24,6)22-14-28(3,4)12-19(22)25(16)32/h8-12,21-22,26,33H,13-14H2,1-7H3/t21-,22-,26?,29-,30+/m0/s1
InChIKeyAKYXRSVOSLDLQF-SOPVXBFCSA-N
Species of MetaboliteComponentSourceComments
Stereum (ncbitaxon:5644) - DOI (10.1016/j.phytol.2016.01.006)
ChEBI Ontology
Outgoing Relation(s)
Sterostrein T (CHEBI:215410) is a tetralins (CHEBI:36786)
IUPAC Name 
(1R,2S)-10-[(3aS,4R)-4-hydroxy-2,2,4-trimethyl-7-oxo-3,3a-dihydroinden-5-yl]-13-methoxy-1,4,4-trimethyl-14-oxatetracyclo[6.6.1.02,6.012,15]pentadeca-5,8,10,12(15)-tetraen-7-one
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78442360ChemSpider