EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:31142 - 7-Deoxypancratistatin

Default Structure
ChEBI IDCHEBI:31142
ChEBI Name7-Deoxypancratistatin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC14H15NO7
Net Charge0
Average Mass309.274
Monoisotopic Mass309.08485
SMILES[H][C@@]12NC(=O)c3cc4c(cc3[C@@]1([H])[C@@H](O)[C@H](O)[C@@H](O)[C@H]2O)OCO4
InChIInChI=1S/C14H15NO7/c16-10-8-4-1-6-7(22-3-21-6)2-5(4)14(20)15-9(8)11(17)13(19)12(10)18/h1-2,8-13,16-19H,3H2,(H,15,20)/t8-,9-,10-,11+,12+,13+/m1/s1
InChIKeyGVGWJJOWWDRYOF-DZDPUUJWSA-N
ChEBI Ontology
Outgoing Relation(s)
7-Deoxypancratistatin (CHEBI:31142) is a phenanthridines (CHEBI:51245)
Synonym  Source
7-DeoxypancratistatinKEGG COMPOUND
Manual XrefsDatabases
C12255KEGG COMPOUND