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CHEBI:207406 - Tolypocladin L

ChEBI IDCHEBI:207406
ChEBI NameTolypocladin L
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H49NO5
Net Charge0
Average Mass587.801
Monoisotopic Mass587.36107
SMILESCC(C)=CCc1ccc2c3c(nc2c1)[C@@]1(C)[C@@H](CC[C@@]2(O)[C@@]45O[C@@H]4[C@@H]4O[C@H](C=C(C)C)OC(C)(C)[C@H]4O[C@H]5CC[C@@]21C)C3
InChIInChI=1S/C37H49NO5/c1-20(2)9-10-22-11-12-24-25-19-23-13-16-36(39)34(7,35(23,8)30(25)38-26(24)18-22)15-14-27-37(36)32(43-37)29-31(40-27)33(5,6)42-28(41-29)17-21(3)4/h9,11-12,17-18,23,27-29,31-32,38-39H,10,13-16,19H2,1-8H3/t23-,27-,28-,29+,31-,32+,34+,35+,36-,37-/m0/s1
InChIKeyDYJCIJFDWCWJAJ-UGGWLMJYSA-N
Species of MetaboliteComponentSourceComments
Tolypocladium (ncbitaxon:29909) - PubMed (30957928)
ChEBI Ontology
Outgoing Relation(s)
Tolypocladin L (CHEBI:207406) is a organic heterotricyclic compound (CHEBI:26979)
Tolypocladin L (CHEBI:207406) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,2S,13S,16S,17S,19R,20R,22S,25S,27S)-1,2,24,24-tetramethyl-7-(3-methylbut-2-enyl)-22-(2-methylprop-1-enyl)-18,21,23,26-tetraoxa-4-azaoctacyclo[14.13.0.02,13.03,11.05,10.017,19.017,27.020,25]nonacosa-3(11),5(10),6,8-tetraen-16-ol