EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:220818 - Benzastatin H

ChEBI IDCHEBI:220818
ChEBI NameBenzastatin H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H26N2O2
Net Charge0
Average Mass302.418
Monoisotopic Mass302.19943
SMILESCC(C)=C(CO)CC/C(C)=C/Cc1cc(C(N)=O)ccc1N
InChIInChI=1S/C18H26N2O2/c1-12(2)16(11-21)7-5-13(3)4-6-14-10-15(18(20)22)8-9-17(14)19/h4,8-10,21H,5-7,11,19H2,1-3H3,(H2,20,22)/b13-4+
InChIKeyDGLVSNIKVGBYHU-YIXHJXPBSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (11513042)
ChEBI Ontology
Outgoing Relation(s)
Benzastatin H (CHEBI:220818) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
4-amino-3-[(2E)-6-(hydroxymethyl)-3,7-dimethylocta-2,6-dienyl]benzamide
Manual XrefsDatabases
8623082ChemSpider