skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > bgt226(1+)
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > bgt226(1+)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > bgt226(1+)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > bgt226(1+)
... > chemical entity > molecular entity > ion > cation > organic cation > bgt226(1+)
... > chemical entity > molecular entity > ion > organic ion > organic cation > bgt226(1+)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic cation > bgt226(1+)

Preferred term

bgt226(1+)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • +1

formula

  • C28H26F3N6O2

inchi

  • InChI=1S/C28H25F3N6O2/c1-35-24-16-33-22-6-3-17(18-4-8-25(39-2)34-15-18)13-20(22)26(24)37(27(35)38)19-5-7-23(21(14-19)28(29,30)31)36-11-9-32-10-12-36/h3-8,13-16,32H,9-12H2,1-2H3/p+1

inchikey

  • BMMXYEBLEBULND-UHFFFAOYSA-O

is_conjugate_acid_of

mass

  • 535.54020

monoisotopicmass

  • 535.20639

smiles

  • COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(N5CC[NH2+]CC5)c(c4)C(F)(F)F)c3c2c1

subset

  • 3_STAR

synonym EXACT

  • 4-{4-[8-(6-methoxypyridin-3-yl)-3-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl]-2-(trifluoromethyl)phenyl}piperazin-1-ium

synonym RELATED

  • BGT226 cation

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:71966

Download this concept:

RDF/XML TURTLE JSON-LD