EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:218545 - Griseusin A

ChEBI IDCHEBI:218545
ChEBI NameGriseusin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H20O10
Net Charge0
Average Mass444.392
Monoisotopic Mass444.10565
SMILESCC(=O)O[C@@H]1C[C@@H](C)O[C@]2(O[C@@H]3CC(=O)O[C@@H]3C3=C2C(=O)c2c(O)cccc2C3=O)[C@@H]1O
InChIInChI=1S/C22H20O10/c1-8-6-13(29-9(2)23)21(28)22(31-8)17-16(20-12(32-22)7-14(25)30-20)18(26)10-4-3-5-11(24)15(10)19(17)27/h3-5,8,12-13,20-21,24,28H,6-7H2,1-2H3/t8-,12-,13-,20+,21-,22-/m1/s1
InChIKeyDKQCCDMPFPKSEP-KSOWGMSTSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (819406)
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)
Griseusin A (CHEBI:218545) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name 
[(3'R,4'R,6'R,11R,15R,17R)-3',4-dihydroxy-6'-methyl-2,9,13-trioxospiro[12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6-tetraene-17,2'-oxane]-4'-yl] acetate
Manual XrefsDatabases
17260009ChemSpider