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CHEBI:220246 - Chlorotonil C2

ChEBI IDCHEBI:220246
ChEBI NameChlorotonil C2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H32O4
Net Charge0
Average Mass384.516
Monoisotopic Mass384.23006
SMILESC[C@@H]1/C=C\C=C\[C@H](C)OC(=O)CC(=O)C=C(O)[C@@H]2[C@H]1C=C[C@@H]1CCC[C@@H](C)[C@@H]21
InChIInChI=1S/C24H32O4/c1-15-7-4-5-9-17(3)28-22(27)14-19(25)13-21(26)24-20(15)12-11-18-10-6-8-16(2)23(18)24/h4-5,7,9,11-13,15-18,20,23-24,26H,6,8,10,14H2,1-3H3/b7-4-,9-5+,21-13?/t15-,16-,17+,18+,20+,23-,24+/m1/s1
InChIKeyPSYJGKOWZZOMRS-GYQZGTEXSA-N
Species of MetaboliteComponentSourceComments
Sorangium (ncbitaxon:39643) - PubMed (26348978)
ChEBI Ontology
Outgoing Relation(s)
Chlorotonil C2 (CHEBI:220246) is a macrolide (CHEBI:25106)
IUPAC Name 
(1S,2R,3Z,5E,7S,14R,15R,16R,20S)-13-hydroxy-2,7,16-trimethyl-8-oxatricyclo[12.8.0.015,20]docosa-3,5,12,21-tetraene-9,11-dione