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CHEBI:219816 - Hamigeran K

ChEBI IDCHEBI:219816
ChEBI NameHamigeran K
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23BrO3
Net Charge0
Average Mass367.283
Monoisotopic Mass366.08306
SMILESCc1cc2c(c(O)c1Br)C(=O)[C@@H](O)[C@]1(C)CC[C@H](C(C)C)[C@H]21
InChIInChI=1S/C18H23BrO3/c1-8(2)10-5-6-18(4)13(10)11-7-9(3)14(19)15(20)12(11)16(21)17(18)22/h7-8,10,13,17,20,22H,5-6H2,1-4H3/t10-,13-,17-,18-/m1/s1
InChIKeyMONXESXAQNTQLQ-INVWZJSISA-N
Species of MetaboliteComponentSourceComments
Hamigera (ncbitaxon:39196) - PubMed (23925673)
ChEBI Ontology
Outgoing Relation(s)
Hamigeran K (CHEBI:219816) is a tetralins (CHEBI:36786)
IUPAC Name 
(1R,3aR,4S,9bR)-7-bromo-4,6-dihydroxy-3a,8-dimethyl-1-propan-2-yl-2,3,4,9b-tetrahydro-1H-cyclopenta[a]naphthalen-5-one
Manual XrefsDatabases
30771408ChemSpider