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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > ggti-2133 free base(1+)
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > ggti-2133 free base(1+)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > ggti-2133 free base(1+)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > ggti-2133 free base(1+)
... > chemical entity > molecular entity > ion > cation > organic cation > ggti-2133 free base(1+)
... > chemical entity > molecular entity > ion > organic ion > organic cation > ggti-2133 free base(1+)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic cation > ggti-2133 free base(1+)

Preferred term

ggti-2133 free base(1+)  

Type

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

Broader concept

charge

  • +1

formula

  • C27H29N4O3

inchi

  • InChI=1S/C27H28N4O3/c1-17(2)12-25(27(33)34)31-26(32)23-11-10-19(29-15-20-14-28-16-30-20)13-24(23)22-9-5-7-18-6-3-4-8-21(18)22/h3-11,13-14,16-17,25,29H,12,15H2,1-2H3,(H,28,30)(H,31,32)(H,33,34)/p+1/t25-/m0/s1

inchikey

  • ODTFPKNIFYMEHP-VWLOTQADSA-O

is_conjugate_acid_of

mass

  • 457.545

monoisotopicmass

  • 457.22342

smiles

  • C([C@H](CC(C)C)NC(=O)C1=C(C=C(C=C1)[NH2+]CC=2NC=NC2)C=3C4=C(C=CC=C4)C=CC3)(O)=O

subset

  • 3_STAR

synonym EXACT

  • 4-{[(1S)-1-carboxy-3-methylbutyl]carbamoyl}-N-[(1H-imidazol-4-yl)methyl]-3-(naphthalen-1-yl)anilinium

synonym RELATED

  • GGTI-2133 free base cation

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:101333

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