EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:44854 - PCNOTAXIME GROUP

Default Structure
ChEBI IDCHEBI:44854
ChEBI NamePCNOTAXIME GROUP
Stars
DownloadsMolfile
FormulaC14H15N5O6S2
Net Charge0
Average Mass413.437
Monoisotopic Mass413.04638
SMILES[H]OC(=O)C1=N[C@@]([H])([C@@]([H])(C(=O)O[H])N([H])C(=O)/C(=N\OC([H])([H])[H])c2nc(N([H])[H])sc2[H])SC([H])([H])C1=C([H])[H]
InChIInChI=1S/C14H15N5O6S2/c1-5-3-26-11(18-7(5)12(21)22)9(13(23)24)17-10(20)8(19-25-2)6-4-27-14(15)16-6/h4,9,11H,1,3H2,2H3,(H2,15,16)(H,17,20)(H,21,22)(H,23,24)/b19-8-/t9-,11+/m0/s1
InChIKeyZRDXEERHKBZJMY-KTFFUYHOSA-N
ChEBI Ontology
Outgoing Relation(s)
PCNOTAXIME GROUP (CHEBI:44854) is a unclassifieds (CHEBI:27189)
Synonym  Source
PCNOTAXIME GROUPPDBeChem
Manual XrefsDatabases
PCZPDBeChem