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CHEBI:175474 - Dihydroxyacidissiminol

Default Structure
ChEBI IDCHEBI:175474
ChEBI NameDihydroxyacidissiminol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H33NO5
Net Charge0
Average Mass427.541
Monoisotopic Mass427.23587
SMILESC/C(=C\COc1ccc(CCNC(=O)c2ccccc2)cc1)C(O)CC(O)C(C)(C)O
InChIInChI=1S/C25H33NO5/c1-18(22(27)17-23(28)25(2,3)30)14-16-31-21-11-9-19(10-12-21)13-15-26-24(29)20-7-5-4-6-8-20/h4-12,14,22-23,27-28,30H,13,15-17H2,1-3H3,(H,26,29)/b18-14+
InChIKeyGDCAKUNBXRNADM-NBVRZTHBSA-N
ChEBI Ontology
Outgoing Relation(s)
Dihydroxyacidissiminol (CHEBI:175474) is a benzamides (CHEBI:22702)
IUPAC Name 
N-[2-[4-[(E)-4,6,7-trihydroxy-3,7-dimethyloct-2-enoxy]phenyl]ethyl]benzamide
Manual XrefsDatabases
35015028ChemSpider
HMDB0040792HMDB