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CHEBI:172650 - Heliocide H3

ChEBI IDCHEBI:172650
ChEBI NameHeliocide H3
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H30O5
Net Charge0
Average Mass410.510
Monoisotopic Mass410.20932
SMILESCC(C)=CCCC1=CCC2C(=O)c3c(C=O)c(O)c(O)c(C(C)C)c3C(=O)C2(C)C1
InChIInChI=1S/C25H30O5/c1-13(2)7-6-8-15-9-10-17-22(28)19-16(12-26)21(27)23(29)18(14(3)4)20(19)24(30)25(17,5)11-15/h7,9,12,14,17,27,29H,6,8,10-11H2,1-5H3
InChIKeyYCZAHJSVHOSXPX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Heliocide H3 (CHEBI:172650) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
2,3-dihydroxy-10a-methyl-6-(4-methylpent-3-enyl)-9,10-dioxo-4-propan-2-yl-8,8a-dihydro-5H-anthracene-1-carbaldehyde
Manual XrefsDatabases
478980ChemSpider
HMDB0030741HMDB