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CHEBI:69850 - citroside B

ChEBI IDCHEBI:69850
ChEBI Namecitroside B
Stars
DefinitionA natural product found in Sanicula lamelligera.
Last Modified16 January 2020
DownloadsMolfile
FormulaC19H30O8
Net Charge0
Average Mass386.441
Monoisotopic Mass386.19407
SMILESCC(=O)C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C19H30O8/c1-10(21)5-6-13-18(2,3)7-11(22)8-19(13,4)27-17-16(25)15(24)14(23)12(9-20)26-17/h5,11-12,14-17,20,22-25H,7-9H2,1-4H3/t6?,11-,12+,14+,15-,16+,17-,19+/m0/s1
InChIKeyXTODSGVDHGMKSN-SIEIHWOKSA-N
Species of MetaboliteComponentSourceComments
Sanicula lamelligera (ncbitaxon:84533) whole plant (BTO:0001461) PubMed (21561060) 80% aqueous ethanolic extract of dried, powdered whole plant
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)
citroside B (CHEBI:69850) has role metabolite (CHEBI:25212)
citroside B (CHEBI:69850) is a allenes (CHEBI:37602)
citroside B (CHEBI:69850) is a terpene glycoside (CHEBI:61777)
Synonym  Source
(1R,5S)-5-Hydroxy-1,3,3-trimethyl-2-(3-oxo-1-buten-1-ylidene)cyclohexyl beta-D-glucopyranosideChEBI
Citations