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CHEBI:190326 - HU-210

ChEBI IDCHEBI:190326
ChEBI NameHU-210
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H38O3
Net Charge0
Average Mass386.576
Monoisotopic Mass386.28210
SMILES[H][C@@]12CC(CO)=CC[C@@]1([H])C(C)(C)Oc1cc(C(C)(C)CCCCCC)cc(O)c12
InChIInChI=1S/C25H38O3/c1-6-7-8-9-12-24(2,3)18-14-21(27)23-19-13-17(16-26)10-11-20(19)25(4,5)28-22(23)15-18/h10,14-15,19-20,26-27H,6-9,11-13,16H2,1-5H3/t19-,20-/m1/s1
InChIKeySSQJFGMEZBFMNV-WOJBJXKFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) intestinal content (NCIT:C189653) MetaboLights (MTBLS4101) Strain: C57BL/6J  [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
HU-210 (CHEBI:190326) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(6aR,10aR)-9-(hydroxymethyl)-6,6-dimethyl-3-(2-methyloctan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol
Manual XrefsDatabases
7997318ChemSpider
Registry NumbersSources
CAS:112830-95-2ChemIDplus