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CHEBI:216457 - Marmycin A

ChEBI IDCHEBI:216457
ChEBI NameMarmycin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H23NO4
Net Charge0
Average Mass413.473
Monoisotopic Mass413.16271
SMILESCc1ccc2c3c(ccc2c1)C(=O)c1c(ccc2c1N[C@@]1(C)C[C@H]2O[C@H](C)[C@H]1O)C3=O
InChIInChI=1S/C26H23NO4/c1-12-4-6-15-14(10-12)5-7-17-20(15)23(28)18-9-8-16-19-11-26(3,25(30)13(2)31-19)27-22(16)21(18)24(17)29/h4-10,13,19,25,27,30H,11H2,1-3H3/t13-,19-,25-,26+/m1/s1
InChIKeyDIIFOOCBJPITQV-IKTXJVIUSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (17844998)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Marmycin A (CHEBI:216457) is a angucycline (CHEBI:48130)
IUPAC Name 
(1R,21S,22S,23R)-22-hydroxy-11,21,23-trimethyl-24-oxa-20-azahexacyclo[19.3.1.02,19.05,18.07,16.08,13]pentacosa-2(19),3,5(18),7(16),8(13),9,11,14-octaene-6,17-dione
Manual XrefsDatabases
23076530ChemSpider