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CHEBI:206909 - Fusicomycin B

ChEBI IDCHEBI:206909
ChEBI NameFusicomycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H60O8
Net Charge0
Average Mass620.868
Monoisotopic Mass620.42882
SMILESCCCC(=O)[C@@H](C)[C@H]1O[C@@](O)([C@H](C)C(=O)OC[C@@H](C)[C@H]2CC[C@]3(C)C[C@@H]4[C@H](CO)C[C@@H](O)[C@H]4[C@@](C)(O)CC=C23)[C@H](C)C[C@H]1C
InChIInChI=1S/C36H60O8/c1-9-10-29(38)23(5)32-20(2)15-22(4)36(42,44-32)24(6)33(40)43-19-21(3)26-11-13-34(7)17-27-25(18-37)16-30(39)31(27)35(8,41)14-12-28(26)34/h12,20-27,30-32,37,39,41-42H,9-11,13-19H2,1-8H3/t20-,21-,22-,23-,24-,25+,26-,27-,30-,31+,32+,34-,35+,36-/m1/s1
InChIKeyONAHYSQENLUUJC-RDKJWPHDSA-N
Species of MetaboliteComponentSourceComments
Streptomyces violascens (ncbitaxon:67381) - PubMed (28206772)
ChEBI Ontology
Outgoing Relation(s)
Fusicomycin B (CHEBI:206909) is a oxanes (CHEBI:46942)
IUPAC Name 
[(2S)-2-[(1R,3R,6R,10S,11S,12R,14R)-10,12-dihydroxy-14-(hydroxymethyl)-3,10-dimethyl-6-tricyclo[9.3.0.03,7]tetradec-7-enyl]propyl] (2S)-2-[(2R,3R,5R,6S)-2-hydroxy-3,5-dimethyl-6-[(2S)-3-oxohexan-2-yl]oxan-2-yl]propanoate