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CHEBI:219677 - 13-epi-dorrigocin A

ChEBI IDCHEBI:219677
ChEBI Name13-epi-dorrigocin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H41NO8
Net Charge0
Average Mass507.624
Monoisotopic Mass507.28322
SMILESCO[C@@H](/C=C/CC/C=C/C(=O)O)[C@@H](O)[C@H](C)/C=C(\C)[C@@H](O)[C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1
InChIInChI=1S/C27H41NO8/c1-17(14-18(2)27(35)22(36-4)12-7-5-6-8-13-25(32)33)26(34)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,18-20,22,26-27,34-35H,5-6,9-11,15-16H2,1-4H3,(H,32,33)(H,28,30,31)/b12-7+,13-8+,17-14+/t18-,19-,22+,26-,27+/m1/s1
InChIKeyHJCZOTBHYAPUHT-FFMZNCFZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (15700980)
ChEBI Ontology
Outgoing Relation(s)
13-epi-dorrigocin A (CHEBI:219677) is a lipid (CHEBI:18059)
IUPAC Name 
(2E,6E,8S,9S,10R,11E,13S,14S)-18-(2,6-dioxopiperidin-4-yl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11-trienoic acid
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