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CHEBI:176274 - Lyciumoside III

ChEBI IDCHEBI:176274
ChEBI NameLyciumoside III
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H56O13
Net Charge0
Average Mass648.787
Monoisotopic Mass648.37209
SMILESC=CC(C)(CC/C=C(\C)CC/C=C(\C)CCC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)O)OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C32H56O13/c1-7-32(6,45-30-28(40)26(38)24(36)21(17-34)43-30)15-9-12-18(2)10-8-11-19(3)13-14-22(31(4,5)41)44-29-27(39)25(37)23(35)20(16-33)42-29/h7,11-12,20-30,33-41H,1,8-10,13-17H2,2-6H3/b18-12+,19-11+
InChIKeyOZHKUJVWCFTHRG-IDXRHMDNSA-N
ChEBI Ontology
Outgoing Relation(s)
Lyciumoside III (CHEBI:176274) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
2-(hydroxymethyl)-6-[(6E,10E)-2-hydroxy-2,6,10,14-tetramethyl-14-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexadeca-6,10,15-trien-3-yl]oxyoxane-3,4,5-triol
Manual XrefsDatabases
HMDB0039553HMDB