EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:206903 - Fusicomycin A

ChEBI IDCHEBI:206903
ChEBI NameFusicomycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H58O8
Net Charge0
Average Mass606.841
Monoisotopic Mass606.41317
SMILESCCC(=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/C35H58O8/c1-9-28(37)22(5)31-19(2)14-21(4)35(41,43-31)23(6)32(39)42-18-20(3)25-10-12-33(7)16-26-24(17-36)15-29(38)30(26)34(8,40)13-11-27(25)33/h11,19-26,29-31,36,38,40-41H,9-10,12-18H2,1-8H3/t19-,20-,21-,22-,23-,24+,25-,26-,29-,30+,31+,33-,34+,35-/m1/s1
InChIKeyHJMPLLRXUQKGPD-BQHLFJOCSA-N
Species of MetaboliteComponentSourceComments
Streptomyces violascens (ncbitaxon:67381) - PubMed (28206772)
ChEBI Ontology
Outgoing Relation(s)
Fusicomycin A (CHEBI:206903) 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-oxopentan-2-yl]oxan-2-yl]propanoate