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CHEBI:209450 - Heronamide E

ChEBI IDCHEBI:209450
ChEBI NameHeronamide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H35NO3
Net Charge0
Average Mass421.581
Monoisotopic Mass421.26169
SMILESCC=CC=CC[C@@H]1C[C@@H]2C=C/C(C)=C/[C@H]3C=C[C@@H](O)[C@@H](O)[C@@H]3/C(C)=C/C=C/[C@H]2C(=O)N1
InChIInChI=1S/C27H35NO3/c1-4-5-6-7-10-22-17-20-13-12-18(2)16-21-14-15-24(29)26(30)25(21)19(3)9-8-11-23(20)27(31)28-22/h4-9,11-16,20-26,29-30H,10,17H2,1-3H3,(H,28,31)/b5-4?,7-6?,11-8+,13-12?,18-16+,19-9+/t20-,21+,22+,23+,24+,25+,26+/m0/s1
InChIKeyUIBDXMJAGQYGAG-RPMFVHBDSA-N
Species of MetaboliteComponentSourceComments
Streptomyces marincola (ncbitaxon:2878388) - PubMed (24547685)
ChEBI Ontology
Outgoing Relation(s)
Heronamide E (CHEBI:209450) is a tetrahydropyridine (CHEBI:26921)
IUPAC Name 
(1S,2E,4E,6R,9R,11R,14E,16R,19R,20S)-9-hexa-2,4-dienyl-19,20-dihydroxy-2,14-dimethyl-8-azatricyclo[14.4.0.06,11]icosa-2,4,12,14,17-pentaen-7-one