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CHEBI:208787 - Cyclotryprostatin F

ChEBI IDCHEBI:208787
ChEBI NameCyclotryprostatin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H27N3O6
Net Charge0
Average Mass441.484
Monoisotopic Mass441.18999
SMILESCOc1ccc2c3c(nc2c1)[C@H](C=C(C)C)N1C(=O)[C@]2(O)CCCN2C(=O)[C@@]1(O)[C@H]3OC
InChIInChI=1S/C23H27N3O6/c1-12(2)10-16-18-17(14-7-6-13(31-3)11-15(14)24-18)19(32-4)23(30)21(28)25-9-5-8-22(25,29)20(27)26(16)23/h6-7,10-11,16,19,24,29-30H,5,8-9H2,1-4H3/t16-,19-,22+,23-/m0/s1
InChIKeyMDKHNEIRSXBBRH-IKPGRFEGSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (31480589)
ChEBI Ontology
Outgoing Relation(s)
Cyclotryprostatin F (CHEBI:208787) is a β-carbolines (CHEBI:60834)
IUPAC Name 
(1S,2S,12S,15R)-1,15-dihydroxy-2,7-dimethoxy-12-(2-methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4(9),5,7-tetraene-14,20-dione
Manual XrefsDatabases
81131459ChemSpider