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CHEBI:202199 - Hypsiziprenol-AA13

ChEBI IDCHEBI:202199
ChEBI NameHypsiziprenol-AA13
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC65H126O12
Net Charge0
Average Mass1099.711
Monoisotopic Mass1098.92493
SMILESC=CC(C)(O)CC/C=C(\C)CCC(O)C(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCC=C(C)C
InChIInChI=1S/C65H126O12/c1-16-55(5,67)32-18-29-53(4)30-31-54(66)65(15,77)51-27-50-64(14,76)49-26-48-63(13,75)47-25-46-62(12,74)45-24-44-61(11,73)43-23-42-60(10,72)41-22-40-59(9,71)39-21-38-58(8,70)37-20-36-57(7,69)35-19-34-56(6,68)33-17-28-52(2)3/h16,28-29,54,66-77H,1,17-27,30-51H2,2-15H3/b53-29+
InChIKeyBHOKARMPSWNIEZ-JHYFMFTFSA-N
Species of MetaboliteComponentSourceComments
Hypsizygus marmoreus (ncbitaxon:39966) - PubMed (10563937)
ChEBI Ontology
Outgoing Relation(s)
Hypsiziprenol-AA13 (CHEBI:202199) is a polyterpenoid (CHEBI:26207)
IUPAC Name 
(6E)-3,7,11,15,19,23,27,31,35,39,43,47,51-tridecamethyldopentaconta-1,6,50-triene-3,10,11,15,19,23,27,31,35,39,43,47-dodecol
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