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CHEBI:199151 - 18Z-lyngbyaloside C

ChEBI IDCHEBI:199151
ChEBI Name18Z-lyngbyaloside C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H45BrO10
Net Charge0
Average Mass621.562
Monoisotopic Mass620.21961
SMILESCO[C@@H]1[C@@H](OC)[C@H](C)O[C@@H](O[C@@H]2C[C@@H]3CC[C@@H](C)[C@H](O)C[C@@](C)(/C=C/C=C\Br)OC(=O)C[C@](O)(C2)O3)[C@@H]1OC
InChIInChI=1S/C28H45BrO10/c1-17-9-10-19-13-20(37-26-25(35-6)24(34-5)23(33-4)18(2)36-26)14-28(32,38-19)16-22(31)39-27(3,15-21(17)30)11-7-8-12-29/h7-8,11-12,17-21,23-26,30,32H,9-10,13-16H2,1-6H3/b11-7+,12-8-/t17-,18+,19+,20-,21-,23+,24-,25-,26+,27-,28+/m1/s1
InChIKeyDFEWAMGJQBKMLJ-SLRCPGGASA-N
Species of MetaboliteComponentSourceComments
Moorena bouillonii (ncbitaxon:207920) - PubMed (20704304)
ChEBI Ontology
Outgoing Relation(s)
18Z-lyngbyaloside C (CHEBI:199151) is a macrolide (CHEBI:25106)
IUPAC Name 
(1S,5S,7R,8R,11S,13R)-5-[(1E,3Z)-4-bromobuta-1,3-dienyl]-1,7-dihydroxy-5,8-dimethyl-13-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-4,15-dioxabicyclo[9.3.1]pentadecan-3-one
Manual XrefsDatabases
78436464ChemSpider