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CHEBI:67240 - lyciumoside IV

ChEBI IDCHEBI:67240
ChEBI Namelyciumoside IV
Stars
DefinitionAn acyclic diterpene glycoside consisting of a 20-hydroxygeranyllinalool skeleton conjugated to a glucosyl residue at C-20 and a rhamnosylglucosyl moiety at C-3.
Last Modified12 March 2013
Submittermwilliams
DownloadsMolfile
FormulaC38H64O16
Net Charge0
Average Mass776.914
Monoisotopic Mass776.41944
SMILESC=C[C@](C)(CC/C=C(\C)CC/C=C(\C)CC/C=C(/C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H]1O
InChIInChI=1S/C38H64O16/c1-7-38(6,54-37-33(48)30(45)34(25(18-40)52-37)53-36-32(47)28(43)26(41)23(5)50-36)16-10-15-21(3)12-8-11-20(2)13-9-14-22(4)19-49-35-31(46)29(44)27(42)24(17-39)51-35/h7,11,14-15,23-37,39-48H,1,8-10,12-13,16-19H2,2-6H3/b20-11+,21-15+,22-14-/t23-,24+,25+,26-,27+,28+,29-,30+,31+,32+,33+,34+,35+,36-,37-,38+/m0/s1
InChIKeyOEOWMDSFDQHCFJ-JUMADDCISA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
lyciumoside IV (CHEBI:67240) has role metabolite (CHEBI:25212)
lyciumoside IV (CHEBI:67240) is a disaccharide derivative (CHEBI:63353)
lyciumoside IV (CHEBI:67240) is a diterpene glycoside (CHEBI:71939)
Incoming Relation(s)
nicotianoside I (CHEBI:67242) has functional parent lyciumoside IV (CHEBI:67240)
nicotianoside II (CHEBI:67243) has functional parent lyciumoside IV (CHEBI:67240)
IUPAC Name 
(3S,6E,10E,14Z)-16-(β-D-glucopyranosyloxy)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl 4-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
Registry NumbersSources
Reaxys:15811855Reaxys
Citations