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CHEBI:200314 - Gymnastatin C

ChEBI IDCHEBI:200314
ChEBI NameGymnastatin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H37Cl2NO6
Net Charge0
Average Mass506.467
Monoisotopic Mass505.19979
SMILESCCCCCCC(C)/C=C(C)/C=C/C(=O)N[C@H]1CC2(OC1OC)[C@H](O)[C@H](Cl)C(=O)[C@H](Cl)[C@H]2O
InChIInChI=1S/C24H37Cl2NO6/c1-5-6-7-8-9-14(2)12-15(3)10-11-17(28)27-16-13-24(33-23(16)32-4)21(30)18(25)20(29)19(26)22(24)31/h10-12,14,16,18-19,21-23,30-31H,5-9,13H2,1-4H3,(H,27,28)/b11-10+,15-12+/t14?,16-,18-,19+,21+,22+,23?,24?/m0/s1
InChIKeyCFUQAHJWAPYZID-OESCQZSVSA-N
Species of MetaboliteComponentSourceComments
Gymnascella dankaliensis (ncbitaxon:166389) - DOI (10.1016/s0040-4039(97)01236-7)
ChEBI Ontology
Outgoing Relation(s)
Gymnastatin C (CHEBI:200314) is a fatty amide (CHEBI:29348)
IUPAC Name 
(2E,4E)-N-[(3S,6S,7S,9R,10S)-7,9-dichloro-6,10-dihydroxy-2-methoxy-8-oxo-1-oxaspiro[4.5]decan-3-yl]-4,6-dimethyldodeca-2,4-dienamide
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