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CHEBI:218431 - Ribocyclophane B

ChEBI IDCHEBI:218431
ChEBI NameRibocyclophane B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC41H64O10
Net Charge0
Average Mass716.953
Monoisotopic Mass716.44995
SMILESCCCC[C@H]1CCCC[C@H](C)[C@@H](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/C41H64O10/c1-5-7-15-26-18-12-10-14-25(4)40(51-41-39(49)38(48)34(46)23-50-41)29-21-32(44)36(33(45)22-29)27(16-8-6-2)17-11-9-13-24(3)37(47)28-19-30(42)35(26)31(43)20-28/h19-22,24-27,34,37-49H,5-18,23H2,1-4H3/t24-,25-,26-,27-,34+,37+,38+,39+,40+,41-/m0/s1
InChIKeyRPTQDUWXNJMHFS-SGDFNLODSA-N
Species of MetaboliteComponentSourceComments
Nostocspecies (ncbitaxon:1180) - PubMed (29381355)
ChEBI Ontology
Outgoing Relation(s)
Ribocyclophane B (CHEBI:218431) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R,3S,8S,13R,14S,19S)-8,19-dibutyl-3,14-dimethyl-13-[(2S,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxytricyclo[18.2.2.29,12]hexacosa-1(22),9,11,20,23,25-hexaene-2,10,21,24,26-pentol
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78442797ChemSpider