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CHEBI:218471 - Ribocyclophane D

ChEBI IDCHEBI:218471
ChEBI NameRibocyclophane D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H66O11
Net Charge0
Average Mass758.990
Monoisotopic Mass758.46051
SMILESCCCC[C@H]1CCCC[C@H](C)[C@@H](OC(C)=O)c2cc(O)c(c(O)c2)[C@@H](CCCC)CCCC[C@H](C)[C@@H](O[C@@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)c2cc(O)c1c(O)c2
InChIInChI=1S/C43H66O11/c1-6-8-16-28-19-13-11-15-26(4)42(54-43-40(51)39(50)36(49)24-52-43)31-22-34(47)38(35(48)23-31)29(17-9-7-2)18-12-10-14-25(3)41(53-27(5)44)30-20-32(45)37(28)33(46)21-30/h20-23,25-26,28-29,36,39-43,45-51H,6-19,24H2,1-5H3/t25-,26-,28-,29-,36+,39+,40+,41+,42+,43-/m0/s1
InChIKeyPWWBCIPAUJDCLH-JPWHELPHSA-N
Species of MetaboliteComponentSourceComments
Nostocspecies (ncbitaxon:1180) - PubMed (29381355)
ChEBI Ontology
Outgoing Relation(s)
Ribocyclophane D (CHEBI:218471) is a glycoside (CHEBI:24400)
IUPAC Name 
[(2R,3S,8S,13R,14S,19S)-8,19-dibutyl-10,21,24,26-tetrahydroxy-3,14-dimethyl-13-[(2S,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2-tricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaenyl] acetate
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78442801ChemSpider