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CHEBI:232054 - mogroside VX

Default Structure
ChEBI IDCHEBI:232054
ChEBI Namemogroside VX
Stars
SubmitterAnne Morgat
DownloadsMolfile
FormulaC60H102O29
Net Charge0
Average Mass1287.447
Monoisotopic Mass1286.65068
SMILES[H][C@@]12CC=C3C(C)(C)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@@]3([H])[C@]1(C)[C@H](O)C[C@@]1(C)[C@@]2(C)CC[C@]1([H])[C@H](C)CC[C@@H](O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O
InChIInChI=1S/C60H102O29/c1-23(9-13-35(57(4,5)79)87-55-50(89-53-48(78)43(73)38(68)29(20-63)83-53)45(75)40(70)31(85-55)22-80-51-46(76)41(71)36(66)27(18-61)81-51)24-15-16-58(6)32-12-10-25-26(60(32,8)33(65)17-59(24,58)7)11-14-34(56(25,2)3)86-54-49(44(74)39(69)30(21-64)84-54)88-52-47(77)42(72)37(67)28(19-62)82-52/h10,23-24,26-55,61-79H,9,11-22H2,1-8H3/t23-,24-,26-,27-,28-,29-,30-,31-,32+,33-,34+,35-,36-,37-,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-,49-,50-,51-,52+,53+,54+,55+,58+,59-,60+/m1/s1
InChIKeyUCQFZURKTALAAG-AKPPXLIXSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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)
mogroside VX (CHEBI:232054) has role plant metabolite (CHEBI:76924)
mogroside VX (CHEBI:232054) is a mogroside (CHEBI:139477)
mogroside VX (CHEBI:232054) is a β-D-glucoside (CHEBI:22798)
Synonym  Source
M5XSUBMITTER
UniProt Name  Source
mogroside VXUniProt
Citations