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CHEBI:212069 - Tartrolon F

ChEBI IDCHEBI:212069
ChEBI NameTartrolon F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H70O14
Net Charge0
Average Mass823.030
Monoisotopic Mass822.47656
SMILESC[C@@H]1CC[C@H]2CC(=O)C[C@@H](O)CC/C=C\C=C/CC[C@H](C)OC(=O)C(O)[C@]3(O)O[C@@H](CC[C@H]3C)CC(O)C[C@@H](O)CC/C=C\C=C/CC[C@H](C)OC(=O)C(O)[C@]1(O)O2
InChIInChI=1S/C44H70O14/c1-29-21-23-37-27-35(47)25-33(45)19-15-11-8-6-10-14-18-32(4)56-42(52)40(50)44(54)30(2)22-24-38(58-44)28-36(48)26-34(46)20-16-12-7-5-9-13-17-31(3)55-41(51)39(49)43(29,53)57-37/h5-12,29-35,37-40,45-47,49-50,53-54H,13-28H2,1-4H3/b9-5-,10-6-,11-8-,12-7-/t29-,30-,31+,32+,33+,34+,35?,37+,38+,39?,40?,43-,44-/m1/s1
InChIKeyQZOYYXRCNOZKAN-PPIFFONHSA-N
Species of MetaboliteComponentSourceComments
Gynuella (ncbitaxon:1445504) - PubMed (31308532)
ChEBI Ontology
Outgoing Relation(s)
Tartrolon F (CHEBI:212069) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,5S,8Z,10E,14S,18S,21R,22R,26S,29Z,31E,35S,39S,42R)-1,2,14,22,23,35,37-heptahydroxy-5,21,26,42-tetramethyl-4,25,43,44-tetraoxatricyclo[37.3.1.118,22]tetratetraconta-8,10,29,31-tetraene-3,16,24-trione
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88293794ChemSpider