EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:207018 - Deformylated antimycin A2a

ChEBI IDCHEBI:207018
ChEBI NameDeformylated antimycin A2a
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H38N2O8
Net Charge0
Average Mass506.596
Monoisotopic Mass506.26282
SMILESCCCCCC[C@H]1C(=O)O[C@H](C)[C@H](NC(=O)c2cccc(N)c2O)C(=O)O[C@@H](C)[C@@H]1OC(=O)C(C)C
InChIInChI=1S/C26H38N2O8/c1-6-7-8-9-11-18-22(36-24(31)14(2)3)16(5)35-26(33)20(15(4)34-25(18)32)28-23(30)17-12-10-13-19(27)21(17)29/h10,12-16,18,20,22,29H,6-9,11,27H2,1-5H3,(H,28,30)/t15-,16+,18-,20+,22+/m1/s1
InChIKeyIMSYIYUBXNRUQG-GNEWFCMESA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies THS-55 (ncbitaxon:1551467) - PubMed (28176847)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Deformylated antimycin A2a (CHEBI:207018) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
[(2R,3S,6S,7R,8R)-3-[(3-amino-2-hydroxybenzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate
Manual XrefsDatabases
61708771ChemSpider