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CHEBI:227676 - Biselyngbyaside F

ChEBI IDCHEBI:227676
ChEBI NameBiselyngbyaside F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H52O9
Net Charge0
Average Mass604.781
Monoisotopic Mass604.36113
SMILESC/C=C/C/C(C)=C/[C@H]1C/C=C/C=C/C[C@H](C)/C=C(\C)[C@@H](OC)C/C=C/[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](OC)[C@H]2O)CC(=O)O1
InChIInChI=1S/C34H52O9/c1-7-8-14-24(3)20-26-16-12-10-9-11-15-23(2)19-25(4)28(39-5)18-13-17-27(21-30(36)41-26)42-34-32(38)33(40-6)31(37)29(22-35)43-34/h7-13,17,19-20,23,26-29,31-35,37-38H,14-16,18,21-22H2,1-6H3/b8-7+,11-9+,12-10+,17-13+,24-20+,25-19+/t23-,26+,27+,28-,29+,31+,32+,33-,34+/m0/s1
InChIKeyQLNOFWPLTFNJPW-QASZSBGESA-N
Species of MetaboliteComponentSourceComments
Lyngbya (ncbitaxon:28073) - DOI (10.1246/bcsj.20150117)
ChEBI Ontology
Outgoing Relation(s)
Biselyngbyaside F (CHEBI:227676) is a macrolide (CHEBI:25106)
IUPAC Name 
(4S,5E,8S,9E,11S,13E,15E,18R)-4-[(2R,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-8-methoxy-9,11-dimethyl-18-[(1E,4E)-2-methylhexa-1,4-dienyl]-1-oxacyclooctadeca-5,9,13,15-tetraen-2-one
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