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CHEBI:208006 - Pyralomicin 1b

ChEBI IDCHEBI:208006
ChEBI NamePyralomicin 1b
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H19Cl2NO7
Net Charge0
Average Mass456.278
Monoisotopic Mass455.05386
SMILESCO[C@@H]1C(CO)=C[C@@H](n2c(Cl)cc3c(=O)c4c(O)c(C)cc(Cl)c4oc32)[C@H](O)[C@H]1O
InChIInChI=1S/C20H19Cl2NO7/c1-7-3-10(21)19-13(14(7)25)15(26)9-5-12(22)23(20(9)30-19)11-4-8(6-24)18(29-2)17(28)16(11)27/h3-5,11,16-18,24-25,27-28H,6H2,1-2H3/t11-,16+,17-,18-/m1/s1
InChIKeyMPBNDUAEVIPFQP-JZDMUPLMSA-N
Species of MetaboliteComponentSourceComments
Microtetraspora (ncbitaxon:1995) - PubMed (8784427)
ChEBI Ontology
Outgoing Relation(s)
Pyralomicin 1b (CHEBI:208006) is a chromones (CHEBI:23238)
IUPAC Name 
2,8-dichloro-1-[(1R,4R,5R,6S)-5,6-dihydroxy-3-(hydroxymethyl)-4-methoxycyclohex-2-en-1-yl]-5-hydroxy-6-methylchromeno[2,3-b]pyrrol-4-one
Manual XrefsDatabases
8965269ChemSpider