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CHEBI:208796 - Delaminomycin B

ChEBI IDCHEBI:208796
ChEBI NameDelaminomycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H45NO6
Net Charge0
Average Mass515.691
Monoisotopic Mass515.32469
SMILESCCC(O)C(C)/C=C/C=C/C(O)CC1C=CC2CC(C)CC(C)C2C1(C)C(O)=C1C(=O)NC(OC)C1=O
InChIInChI=1S/C30H45NO6/c1-7-23(33)18(3)10-8-9-11-22(32)16-21-13-12-20-15-17(2)14-19(4)25(20)30(21,5)27(35)24-26(34)29(37-6)31-28(24)36/h8-13,17-23,25,29,32-33,35H,7,14-16H2,1-6H3,(H,31,36)/b10-8+,11-9+,27-24?
InChIKeyFEGZBWWSFAYQDU-JHQKYWRISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (8393848)
ChEBI Ontology
Outgoing Relation(s)
Delaminomycin B (CHEBI:208796) is a pyrrolidinone (CHEBI:38275)
IUPAC Name 
3-[[2-[(3E,5E)-2,8-dihydroxy-7-methyldeca-3,5-dienyl]-1,6,8-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-hydroxymethylidene]-5-methoxypyrrolidine-2,4-dione
Manual XrefsDatabases
78443679ChemSpider