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CHEBI:210399 - Hexaricin E

ChEBI IDCHEBI:210399
ChEBI NameHexaricin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H24O10
Net Charge0
Average Mass544.512
Monoisotopic Mass544.13695
SMILESCCC(=O)O[C@@H]1Cc2cc3c(c(O)c2-c2c(O)c4c(c(OC)c21)C(=O)c1c(O)cccc1C4=O)C(=O)OC(C)C3
InChIInChI=1S/C30H24O10/c1-4-17(32)40-16-10-13-9-12-8-11(2)39-30(37)19(12)26(34)18(13)22-21(16)29(38-3)24-23(28(22)36)25(33)14-6-5-7-15(31)20(14)27(24)35/h5-7,9,11,16,31,34,36H,4,8,10H2,1-3H3/t11?,16-/m1/s1
InChIKeyAKYMKELYWCSLHP-WVQRXBFSSA-N
Species of MetaboliteComponentSourceComments
Streptosporangium (ncbitaxon:2000) - PubMed (30178674)
ChEBI Ontology
Outgoing Relation(s)
Hexaricin E (CHEBI:210399) is a quinone (CHEBI:36141)
Hexaricin E (CHEBI:210399) is a tetracenes (CHEBI:51270)
IUPAC Name 
[(13R)-3,19,26-trihydroxy-15-methoxy-7-methyl-5,17,24-trioxo-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-nonaen-13-yl] propanoate
Manual XrefsDatabases
71048479ChemSpider