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CHEBI:210423 - Hexaricin A

ChEBI IDCHEBI:210423
ChEBI NameHexaricin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H20O9
Net Charge0
Average Mass488.448
Monoisotopic Mass488.11073
SMILESCOc1c2c(c(O)c3c1[C@H](O)Cc1cc4c(c(O)c1-3)C(=O)O[C@H](C)C4)C(=O)c1cccc(O)c1C2=O
InChIInChI=1S/C27H20O9/c1-9-6-10-7-11-8-14(29)18-19(15(11)23(31)16(10)27(34)36-9)25(33)20-21(26(18)35-2)24(32)17-12(22(20)30)4-3-5-13(17)28/h3-5,7,9,14,28-29,31,33H,6,8H2,1-2H3/t9-,14-/m1/s1
InChIKeyHRWPMELFEHBAIH-YMTOWFKASA-N
Species of MetaboliteComponentSourceComments
Streptosporangium (ncbitaxon:2000) - PubMed (30178674)
ChEBI Ontology
Outgoing Relation(s)
Hexaricin A (CHEBI:210423) is a quinone (CHEBI:36141)
Hexaricin A (CHEBI:210423) is a tetracenes (CHEBI:51270)
IUPAC Name 
(7R,13R)-3,13,19,26-tetrahydroxy-15-methoxy-7-methyl-6-oxahexacyclo[12.12.0.02,11.04,9.016,25.018,23]hexacosa-1(14),2(11),3,9,15,18(23),19,21,25-nonaene-5,17,24-trione
Manual XrefsDatabases
60596942ChemSpider