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CHEBI:187411 - Cyanidin 3-lathyroside

Default Structure
ChEBI IDCHEBI:187411
ChEBI NameCyanidin 3-lathyroside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H29O15
Net Charge+1
Average Mass581.503
Monoisotopic Mass581.15010
SMILESOCC1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)C(O[C@@H]2OC[C@@H](O)C(O)[C@H]2O)C(O)[C@H]1O
InChIInChI=1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1/t15-,18?,19?,20+,21?,22-,24?,25+,26-/m1/s1
InChIKeyZPPQIOUITZSYAO-HVHHODJLSA-O
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Cyanidin 3-lathyroside (CHEBI:187411) is a anthocyanidin glycoside (CHEBI:71583)
IUPAC Name 
(2S,3R,5R)-2-[(2S,5R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
Manual XrefsDatabases
24842143ChemSpider
LMPK12010096LIPID MAPS