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CHEBI:216648 - Speradine F

ChEBI IDCHEBI:216648
ChEBI NameSperadine F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22N2O7
Net Charge0
Average Mass414.414
Monoisotopic Mass414.14270
SMILESCC(=O)[C@@]1(O)C(=O)N2C(C)(C)[C@@H]3Cc4cccc5c4[C@@]4(O[C@@]1(O)[C@@]2(O)[C@H]34)C(=O)N5C
InChIInChI=1S/C21H22N2O7/c1-9(24)19(27)16(26)23-17(2,3)11-8-10-6-5-7-12-13(10)18(15(25)22(12)4)14(11)20(23,28)21(19,29)30-18/h5-7,11,14,27-29H,8H2,1-4H3/t11-,14-,18+,19-,20+,21-/m1/s1
InChIKeyQLOOWQVCXQPADP-UMHNQWNOSA-N
Species of MetaboliteComponentSourceComments
Aspergillus oryzae (ncbitaxon:5062) - PubMed (24966178)
ChEBI Ontology
Outgoing Relation(s)
Speradine F (CHEBI:216648) is a naphthofuran (CHEBI:39270)