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CHEBI:227090 - Jiangrine D

ChEBI IDCHEBI:227090
ChEBI NameJiangrine D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H21NO5
Net Charge0
Average Mass319.357
Monoisotopic Mass319.14197
SMILESCO[C@@H](c1ccc(C=O)n1CCc1ccc(O)cc1)[C@H](O)CO
InChIInChI=1S/C17H21NO5/c1-23-17(16(22)11-20)15-7-4-13(10-19)18(15)9-8-12-2-5-14(21)6-3-12/h2-7,10,16-17,20-22H,8-9,11H2,1H3/t16-,17+/m1/s1
InChIKeyBRXGBJMQZQFKJV-SJORKVTESA-N
Species of MetaboliteComponentSourceComments
Jiangella gansuensis (ncbitaxon:281473) - PubMed (25412141)
ChEBI Ontology
Outgoing Relation(s)
Jiangrine D (CHEBI:227090) is a phenols (CHEBI:33853)
IUPAC Name 
5-[(1S,2R)-2,3-dihydroxy-1-methoxypropyl]-1-[2-(4-hydroxyphenyl)ethyl]pyrrole-2-carbaldehyde
Manual XrefsDatabases
58128089ChemSpider