CHEBI:230511 - mogroside MIII-A1

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name mogroside MIII-A1
ChEBI ID CHEBI:230511
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information
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Formula C48H82O19
Net Charge 0
Average Mass 963.165
Monoisotopic Mass 962.54503
InChI InChI=1S/C48H82O19/c1-21(22-15-16-46(6)28-12-10-23-24(11-13-29(51)44(23,2)3)48(28,8)30(52)17-47(22,46)7)9-14-31(45(4,5)61)66-43-40(67-42-39(60)36(57)33(54)26(19-50)64-42)37(58)34(55)27(65-43)20-62-41-38(59)35(56)32(53)25(18-49)63-41/h10,21-22,24-43,49-61H,9,11-20H2,1-8H3/t21-,22-,24-,25-,26-,27-,28+,29+,30-,31-,32-,33-,34-,35+,36+,37+,38-,39-,40-,41-,42+,43+,46+,47-,48+/m1/s1
InChIKey DDDXYRAMQRKPDO-GOILQDHQSA-N
SMILES O[C@H]1[C@@]2([C@]([C@]3([C@@]([C@](CC3)([C@@H](CC[C@@H](O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)CO)CO[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)CO)C(O)(C)C)C)[H])(C1)C)C)(CC=C7[C@]2(CC[C@H](O)C7(C)C)[H])[H])C
Roles Classification
Biological Role(s): 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.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing mogroside MIII-A1 (CHEBI:230511) has functional parent mogroside IIA (CHEBI:229960)
mogroside MIII-A1 (CHEBI:230511) has role plant metabolite (CHEBI:76924)
mogroside MIII-A1 (CHEBI:230511) is a β-D-glucoside (CHEBI:22798)
mogroside MIII-A1 (CHEBI:230511) is a mogroside (CHEBI:139477)
Synonyms Sources
M3A1 SUBMITTER
mogroside MIII-A1 UniProt
Citation Waiting for Citations Type Source
27821754 PubMed citation SUBMITTER