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CHEBI:206569 - (+/-)-aspergilol H

ChEBI IDCHEBI:206569
ChEBI Name(+/-)-aspergilol H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H30O10
Net Charge0
Average Mass598.604
Monoisotopic Mass598.18390
SMILESCC(=O)CCC[C@@H](c1c(C)cc(Oc2cc(C)cc(O)c2)cc1O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C34H30O10/c1-15-7-18(36)10-20(8-15)44-21-9-16(2)28(26(39)13-21)22(6-4-5-17(3)35)29-27(40)14-24-31(33(29)42)34(43)30-23(32(24)41)11-19(37)12-25(30)38/h7-14,22,36-40,42H,4-6H2,1-3H3/t22-/m0/s1
InChIKeySPVJSIDQBCYIGG-QFIPXVFZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (28129981)
ChEBI Ontology
Outgoing Relation(s)
(+/-)-aspergilol H (CHEBI:206569) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
1,3,6,8-tetrahydroxy-2-[1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-5-oxohexyl]anthracene-9,10-dione
Manual XrefsDatabases
61362074ChemSpider