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CHEBI:227489 - Divergolide L

ChEBI IDCHEBI:227489
ChEBI NameDivergolide L
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H35NO7
Net Charge0
Average Mass521.610
Monoisotopic Mass521.24135
SMILESCC[C@@H](/C=C/[C@H](O)[C@@H](O)C=C(C)C)CCC(=O)c1c(O)c(C)cc2c1C(=O)C1=C(NC(=O)CC=C1C)C2=O
InChIInChI=1S/C30H35NO7/c1-6-18(8-10-20(32)22(34)13-15(2)3)9-11-21(33)26-25-19(14-17(5)28(26)36)29(37)27-24(30(25)38)16(4)7-12-23(35)31-27/h7-8,10,13-14,18,20,22,32,34,36H,6,9,11-12H2,1-5H3,(H,31,35)/b10-8+/t18-,20-,22-/m0/s1
InChIKeyDZLIXQNVAUXJOZ-AJQQJHNRSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (25464499)
ChEBI Ontology
Outgoing Relation(s)
Divergolide L (CHEBI:227489) is a naphthoquinone (CHEBI:25481)
IUPAC Name 
7-[(4R,5E,7S,8S)-4-ethyl-7,8-dihydroxy-10-methylundeca-5,9-dienoyl]-8-hydroxy-5,9-dimethyl-1,3-dihydrobenzo[h][1]benzazepine-2,6,11-trione
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