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CHEBI:204505 - methyl 2-[(1R,3R,4R)-4,9-dihydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetate

ChEBI IDCHEBI:204505
ChEBI Namemethyl 2-[(1R,3R,4R)-4,9-dihydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O7
Net Charge0
Average Mass360.362
Monoisotopic Mass360.12090
SMILESCCC[C@H]1O[C@H](CC(=O)OC)[C@H](O)C2=C1C(=O)c1c(O)cccc1C2=O
InChIInChI=1S/C19H20O7/c1-3-5-11-15-16(18(23)12(26-11)8-13(21)25-2)17(22)9-6-4-7-10(20)14(9)19(15)24/h4,6-7,11-12,18,20,23H,3,5,8H2,1-2H3/t11-,12-,18+/m1/s1
InChIKeyNBXPOHABGLVLNR-FMTVUPSXSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (11302493)
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
methyl 2-[(1R,3R,4R)-4,9-dihydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetate (CHEBI:204505) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name 
methyl 2-[(1R,3R,4R)-4,9-dihydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetate
Manual XrefsDatabases
7974733ChemSpider