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CHEBI:201564 - Macrosphelide C

ChEBI IDCHEBI:201564
ChEBI NameMacrosphelide C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O7
Net Charge0
Average Mass326.345
Monoisotopic Mass326.13655
SMILESC[C@@H]1OC(=O)C[C@H](C)OC(=O)/C=C/C[C@H](C)OC(=O)/C=C/[C@H]1O
InChIInChI=1S/C16H22O7/c1-10-5-4-6-14(18)22-11(2)9-16(20)23-12(3)13(17)7-8-15(19)21-10/h4,6-8,10-13,17H,5,9H2,1-3H3/b6-4+,8-7+/t10-,11-,12-,13+/m0/s1
InChIKeyLHDGUPDIEZSEGS-HRABQTKNSA-N
ChEBI Ontology
Outgoing Relation(s)
Macrosphelide C (CHEBI:201564) is a macrolide (CHEBI:25106)
IUPAC Name 
(4S,7E,10S,13E,15R,16S)-15-hydroxy-4,10,16-trimethyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione
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