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CHEBI:215900 - Sucro-neolambertillin

ChEBI IDCHEBI:215900
ChEBI NameSucro-neolambertillin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H30O15
Net Charge0
Average Mass582.511
Monoisotopic Mass582.15847
SMILESCc1cc2cc(O[C@]3(CO)O[C@@](CO)(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@@H]3O)c3c(O)cccc3c2oc1=O
InChIInChI=1S/C26H30O15/c1-10-5-11-6-14(16-12(3-2-4-13(16)30)20(11)38-23(10)36)39-25(8-28)21(34)22(35)26(9-29,41-25)40-24-19(33)18(32)17(31)15(7-27)37-24/h2-6,15,17-19,21-22,24,27-35H,7-9H2,1H3/t15-,17-,18+,19-,21+,22+,24-,25-,26-/m1/s1
InChIKeyHABCTTDPKMSEOW-FPAQFCJTSA-N
Species of MetaboliteComponentSourceComments
Lambertella (ncbitaxon:38462) - PubMed (18236483)
ChEBI Ontology
Outgoing Relation(s)
Sucro-neolambertillin (CHEBI:215900) is a glycoside (CHEBI:24400)
IUPAC Name 
6-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]oxy-7-hydroxy-3-methylbenzo[h]chromen-2-one
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78437549ChemSpider