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CHEBI:9687 - Trichocarpin

ChEBI IDCHEBI:9687
ChEBI NameTrichocarpin
Stars
Last Modified3 December 2015
DownloadsMolfile
FormulaC20H22O9
Net Charge0
Average Mass406.387
Monoisotopic Mass406.12638
SMILESO=C(OCc1ccccc1)c1cc(O)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C20H22O9/c21-9-15-16(23)17(24)18(25)20(29-15)28-14-7-6-12(22)8-13(14)19(26)27-10-11-4-2-1-3-5-11/h1-8,15-18,20-25H,9-10H2/t15-,16-,17+,18-,20-/m1/s1
InChIKeyQJWRHLSORLOREK-BFMVXSJESA-N
ChEBI Ontology
Outgoing Relation(s)
Trichocarpin (CHEBI:9687) is a benzyl ester (CHEBI:90628)
Synonym  Source
TrichocarpinKEGG COMPOUND
Manual XrefsDatabases
C10835KEGG COMPOUND
C00002677KNApSAcK
Registry NumbersSources
CAS:10590-85-9KEGG COMPOUND