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CHEBI:198060 - Fischambiguine A

ChEBI IDCHEBI:198060
ChEBI NameFischambiguine A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H30N2O
Net Charge0
Average Mass386.539
Monoisotopic Mass386.23581
SMILES[C-]#[N+][C@]12C(=C)C(C)(C)c3nc4cccc5c4c3[C@]1(O)[C@H](CC[C@]2(C)C=C)C5(C)C
InChIInChI=1S/C26H30N2O/c1-9-24(7)14-13-18-23(5,6)16-11-10-12-17-19(16)20-21(28-17)22(3,4)15(2)26(24,27-8)25(18,20)29/h9-12,18,28-29H,1-2,13-14H2,3-7H3/t18-,24+,25-,26+/m1/s1
InChIKeyVARACNJZOYFAJE-JBSJPJJHSA-N
Species of MetaboliteComponentSourceComments
Fischerella ambigua UTEX 1903 (ncbitaxon:230521) - PubMed (20965528)
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
Fischambiguine A (CHEBI:198060) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(10R,11R,14R,15R)-11-ethenyl-10-isocyano-8,8,11,18,18-pentamethyl-9-methylidene-6-azapentacyclo[12.3.1.05,17.07,16.010,15]octadeca-1(17),2,4,7(16)-tetraen-15-ol
Manual XrefsDatabases
28288193ChemSpider