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CHEBI:199173 - (3R,5R)-6,6,14-trihydroxy-3-methyl-4,18,19,22-tetraoxahexacyclo[15.2.2.11,7.03,5.08,17.010,15]docosa-7,10(15),11,13,20-pentaene-9,16-dione

ChEBI IDCHEBI:199173
ChEBI Name(3R,5R)-6,6,14-trihydroxy-3-methyl-4,18,19,22-tetraoxahexacyclo[15.2.2.11,7.03,5.08,17.010,15]docosa-7,10(15),11,13,20-pentaene-9,16-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H14O9
Net Charge0
Average Mass386.312
Monoisotopic Mass386.06378
SMILESC[C@@]12CC34C=CC5(OO3)C(=O)c3c(O)cccc3C(=O)C5=C(O4)C(O)(O)[C@@H]1O2
InChIInChI=1S/C19H14O9/c1-16-7-17-5-6-18(28-27-17)11(14(25-17)19(23,24)15(16)26-16)12(21)8-3-2-4-9(20)10(8)13(18)22/h2-6,15,20,23-24H,7H2,1H3/t15-,16-,17?,18?/m1/s1
InChIKeyHCUSIFCDXBNESE-MRLCAUJQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1021/jo00081a020)
ChEBI Ontology
Outgoing Relation(s)
(3R,5R)-6,6,14-trihydroxy-3-methyl-4,18,19,22-tetraoxahexacyclo[15.2.2.11,7.03,5.08,17.010,15]docosa-7,10(15),11,13,20-pentaene-9,16-dione (CHEBI:199173) is a naphthoquinone (CHEBI:25481)
IUPAC Name 
(3R,5R)-6,6,14-trihydroxy-3-methyl-4,18,19,22-tetraoxahexacyclo[15.2.2.11,7.03,5.08,17.010,15]docosa-7,10(15),11,13,20-pentaene-9,16-dione
Manual XrefsDatabases
8493435ChemSpider