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CHEBI:51394 - β-decafluoro-meso-decamethylcalix[5]pyrrole

Default Structure
ChEBI IDCHEBI:51394
ChEBI Nameβ-decafluoro-meso-decamethylcalix[5]pyrrole
Stars
ASCII Namebeta-decafluoro-meso-decamethylcalix[5]pyrrole
Last Modified15 January 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC35H35F10N5
Net Charge0
Average Mass715.680
Monoisotopic Mass715.27328
SMILESCC1(C)c2nc(c(F)c2F)C(C)(C)c2nc(c(F)c2F)C(C)(C)c2nc(c(F)c2F)C(C)(C)c2nc(c(F)c2F)C(C)(C)c2nc1c(F)c2F
InChIInChI=1S/C35H35F10N5/c1-31(2)21-11(36)13(38)23(46-21)32(3,4)25-15(40)17(42)27(48-25)34(7,8)29-19(44)20(45)30(50-29)35(9,10)28-18(43)16(41)26(49-28)33(5,6)24-14(39)12(37)22(31)47-24/h46-50H,1-10H3
InChIKeyZJRVKYBCGFVFRX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
β-decafluoro-meso-decamethylcalix[5]pyrrole (CHEBI:51394) has parent hydride calix[5]pyrrole (CHEBI:51395)
β-decafluoro-meso-decamethylcalix[5]pyrrole (CHEBI:51394) is a substituted calixpyrrole (CHEBI:51392)
IUPAC Name 
4,5,9,10,14,15,19,20,24,25-decafluoro-2,2,7,7,12,12,17,17,22,22-decamethyl-26,27,28,29,30-pentaazahexacyclo[21.2.1.13,6.18,11.113,16.118,21]triaconta-1(25),3,5,8,10,13,15,18,20,23-decaene
Registry NumbersSources
Beilstein:8891320Beilstein