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CHEBI:211838 - Streptoanthraquinone A

ChEBI IDCHEBI:211838
ChEBI NameStreptoanthraquinone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H22O8
Net Charge0
Average Mass486.476
Monoisotopic Mass486.13147
SMILESCC(=O)O[C@@H]1c2c3c(c(O)c4c2[C@H](Cc2c(O)cc(C)cc2-4)O[C@@H]1C)C(=O)c1cccc(O)c1C3=O
InChIInChI=1S/C28H22O8/c1-10-7-15-14(17(31)8-10)9-18-21-20(15)27(34)24-22(23(21)28(11(2)35-18)36-12(3)29)26(33)19-13(25(24)32)5-4-6-16(19)30/h4-8,11,18,28,30-31,34H,9H2,1-3H3/t11-,18+,28+/m1/s1
InChIKeyHTMHRMTVLWOVAR-IHHQDRDUSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (26751456)
ChEBI Ontology
Outgoing Relation(s)
Streptoanthraquinone A (CHEBI:211838) is a quinone (CHEBI:36141)
Streptoanthraquinone A (CHEBI:211838) is a tetracenes (CHEBI:51270)
IUPAC Name 
[(21S,23R,24R)-5,12,18-trihydroxy-16,23-dimethyl-3,10-dioxo-22-oxahexacyclo[11.11.1.02,11.04,9.014,19.021,25]pentacosa-1,4(9),5,7,11,13(25),14(19),15,17-nonaen-24-yl] acetate
Manual XrefsDatabases
78439212ChemSpider