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ciguatoxin ABCDE ring fragment
A polycyclic ether comprising a linear sequence of five trans-fused oxacycles (three oxepines and two pyrans) which corresponds to the ABCDE ring fragment of ciguatoxin CTX1B.


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03. Biological Effects of Specific Chemicals: epitope [CHEBI:53000] > ciguatoxin ABCDE ring fragment [CHEBI:70748]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 epitope [CHEBI:53000] (470) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 organooxygen compound [CHEBI:36963] (11352) 
 ether [CHEBI:25698] (876) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 ether [CHEBI:25698] (876) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 ether [CHEBI:25698] (876) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic molecule [CHEBI:72695] (11399) 
 organic cyclic compound [CHEBI:33832] (7633) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 molecule [CHEBI:25367] (11520) 
 cyclic compound [CHEBI:33595] (7817) 
 polycyclic compound [CHEBI:33635] (4078) 
 heteropolycyclic compound [CHEBI:33671] (2613) 
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic cyclic compound [CHEBI:33832] (7633) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 heterocyclic compound [CHEBI:5686] (5275) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 heteropolycyclic compound [CHEBI:33671] (2613) 
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic molecule [CHEBI:72695] (11399) 
 organic cyclic compound [CHEBI:33832] (7633) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 oxacycle [CHEBI:38104] (2002) 
 cyclic ether [CHEBI:37407] (314) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 polycyclic ether [CHEBI:36468] (25) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
 organic heteropentacyclic compound [CHEBI:38164] (100) 
 ciguatoxin ABCDE ring fragment [CHEBI:70748] (1)
ChEBI Compound Accession Identifier  [CHEBI:70748]
ChEBI Compound Description  A polycyclic ether comprising a linear sequence of five trans-fused oxacycles (three oxepines and two pyrans) which corresponds to the ABCDE ring fragment of ciguatoxin CTX1B.
ChEBI Compound Identification Number  70748
ChEBI InChI Value  InChI=1S/C27H36O9/c1-2-4-18-17(30)9-10-19-20(33-18)11-12-21-23(34-19)13-24-27(36-21)25(31)26-22(35-24)6-3-5-16(32-26)8-7-15(29)14-28/h2-3,5,7-12,15-31H,1,4,6,13-14H2/b8-7+/t15-,16+,17-,18+,19+,20-,21+,22-,23-,24+,25+,26-,27+/m0/s1
ChEBI InChIKey Value  RXQHGRDQAGUJLF-NISFGDLFSA-N
ChEBI Compound Name  ciguatoxin ABCDE ring fragment
ChEBI SMILES Value  [H][C@]1(O)C=C[C@@]2([H])O[C@@]3([H])C[C@@]4([H])O[C@@]5([H])CC=C[C@@]([H])(O[C@]5([H])[C@@H](O)[C@]4([H])O[C@]3([H])C=C[C@]2([H])O[C@]1([H])CC=C)\C=C\[C@H](O)CO
ChEBI Substance ID  160645992
ChEBI URL  ChEBI:70748
ChemSpider ID  NS
Ontomatica Chemical Accession Key (OnChAKey)  RXQHGRDQAGUJLF_NISFGDLFSA_N_000_000000
PubChem Compound ID  70679006