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CHEBI:224914 - Clifednamide G

ChEBI IDCHEBI:224914
ChEBI NameClifednamide G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H34N2O7
Net Charge0
Average Mass522.598
Monoisotopic Mass522.23660
SMILESCC(=O)[C@H]1[C@@H]2C=C[C@H](/C=C/C=C/C(N)=O)[C@H](/C=C/C=C/C(O)=C3C(=O)N[C@@H](CCC(=O)O)C3=O)[C@H]2C[C@H]1C
InChIInChI=1S/C29H34N2O7/c1-16-15-21-19(18(7-3-6-10-24(30)34)11-12-20(21)26(16)17(2)32)8-4-5-9-23(33)27-28(37)22(31-29(27)38)13-14-25(35)36/h3-12,16,18-22,26,33H,13-15H2,1-2H3,(H2,30,34)(H,31,38)(H,35,36)/b7-3+,8-4+,9-5+,10-6+,27-23?/t16-,18+,19+,20-,21-,22+,26+/m1/s1
InChIKeyFHKOBILSYIITHS-LMPYDYSBSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32915576)
ChEBI Ontology
Outgoing Relation(s)
Clifednamide G (CHEBI:224914) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name 
3-[(2S)-4-[(2E,4E)-5-[(1R,2R,3aR,4R,5S,7aR)-1-acetyl-5-[(1E,3E)-5-amino-5-oxopenta-1,3-dienyl]-2-methyl-2,3,3a,4,5,7a-hexahydro-1H-inden-4-yl]-1-hydroxypenta-2,4-dienylidene]-3,5-dioxopyrrolidin-2-yl]propanoic acid