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CHEBI:69485 - Spiruchostatin C

ChEBI IDCHEBI:69485
ChEBI NameSpiruchostatin C
Stars
DefinitionA natural product found in Burkholderia thailandensis E264.
Last Modified5 November 2015
DownloadsMolfile
FormulaC23H37N3O7S3
Net Charge0
Average Mass563.764
Monoisotopic Mass563.17936
SMILES[H][C@]1([C@@H](C)CC)NC(=O)[C@H]2CSSCC/C=C/[C@H](CC(=O)N[C@H](CCS(C)=O)C(=O)N2)OC(=O)C[C@@H]1O
InChIInChI=1S/C23H37N3O7S3/c1-4-14(2)21-18(27)12-20(29)33-15-7-5-6-9-34-35-13-17(23(31)26-21)25-22(30)16(8-10-36(3)32)24-19(28)11-15/h5,7,14-18,21,27H,4,6,8-13H2,1-3H3,(H,24,28)(H,25,30)(H,26,31)/b7-5+/t14-,15+,16+,17+,18-,21+,36?/m0/s1
InChIKeyDISXKJJDDVRQSD-KLMIADJASA-N
Species of MetaboliteComponentSourceComments
Burkholderia thailandensis E264 (ncbitaxon:271848) - PubMed (21967146) Ethyl acetate extract
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Spiruchostatin C (CHEBI:69485) has role metabolite (CHEBI:25212)
Spiruchostatin C (CHEBI:69485) is a cyclodepsipeptide (CHEBI:35213)
Spiruchostatin C (CHEBI:69485) is a spiruchostatin (CHEBI:90234)
Synonym  Source
(1S,5S,6R,9S,15E,20R)-6-[(2S)-2-Butanyl]-5-hydroxy-20-[2-(methylsulfinyl)ethyl]-2-oxa-11,12-dithia-7,19,22-triazabicyclo[7.7.6]docos-15-ene-3,8,18,21-tetroneChEBI
Citations