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CHEBI:189934 - Lansioside C

ChEBI IDCHEBI:189934
ChEBI NameLansioside C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H56O7
Net Charge0
Average Mass588.826
Monoisotopic Mass588.40260
SMILESC=C(C)C1CC=C(C)C(CCC2C(=C)CCC3C(C)(C)C(OC4OCC(O)C(O)C4O)CCC23C)C1(C)CCC(=O)O
InChIInChI=1S/C35H56O7/c1-20(2)23-11-9-21(3)24(34(23,7)18-16-29(37)38)12-13-25-22(4)10-14-27-33(5,6)28(15-17-35(25,27)8)42-32-31(40)30(39)26(36)19-41-32/h9,23-28,30-32,36,39-40H,1,4,10-19H2,2-3,5-8H3,(H,37,38)
InChIKeyILGQYZQREAJTIJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
marine plankton environmental sample (ncbitaxon:632957) endometabolome MetaboLights (MTBLS3038)
ChEBI Ontology
Outgoing Relation(s)
Lansioside C (CHEBI:189934) is a glycoside (CHEBI:24400)
IUPAC Name 
3-[2-[2-[5,5,8a-trimethyl-2-methylidene-6-(3,4,5-trihydroxyoxan-2-yl)oxy-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-1,3-dimethyl-6-prop-1-en-2-ylcyclohex-3-en-1-yl]propanoic acid
Manual XrefsDatabases
HMDB0035103HMDB