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CHEBI:212527 - Blastmycetin D

ChEBI IDCHEBI:212527
ChEBI NameBlastmycetin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H43N3O3
Net Charge0
Average Mass469.670
Monoisotopic Mass469.33044
SMILESC=C[C@@](C)(CCC(C)(O)C(C)C)c1ccc2c3c(cnc13)C[C@@H](CO)NC(=O)[C@H](C(C)C)N2C
InChIInChI=1S/C28H43N3O3/c1-9-27(6,12-13-28(7,34)18(4)5)21-10-11-22-23-19(15-29-24(21)23)14-20(16-32)30-26(33)25(17(2)3)31(22)8/h9-11,15,17-18,20,25,29,32,34H,1,12-14,16H2,2-8H3,(H,30,33)/t20-,25-,27-,28?/m0/s1
InChIKeySGRJIMVSBPLGOV-BMNPVRIOSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1271/bbb1961.51.1733)
ChEBI Ontology
Outgoing Relation(s)
Blastmycetin D (CHEBI:212527) is a amino acid amide (CHEBI:22475)
IUPAC Name 
(10S,13S)-13-(hydroxymethyl)-5-[(3R)-6-hydroxy-3,6,7-trimethyloct-1-en-3-yl]-9-methyl-10-propan-2-yl-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1,4,6,8(15)-tetraen-11-one
Manual XrefsDatabases
58837552ChemSpider