CHEBI:190326 - HU-210

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name HU-210
ChEBI ID CHEBI:190326
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H38O3
Net Charge 0
Average Mass 386.576
Monoisotopic Mass 386.28210
InChI InChI=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
InChIKey SSQJFGMEZBFMNV-WOJBJXKFSA-N
SMILES O1C([C@]2([C@@](CC(=CC2)CO)(C=3C1=CC(C(CCCCCC)(C)C)=CC3O)[H])[H])(C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in intestinal content (NCIT:C189653). of strain C57BL/6J  [EFO:0000606] See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
7997318 ChemSpider
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Registry Number Type Source
112830-95-2 CAS Registry Number ChemIDplus