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Camalexin

  • Formula: C11H8N2S

  • Molecular weight: 200.26

  • Smiles: C1=CC=C2C(=C1)C(=CN2)C3=NC=CS3

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Camalexin

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: Camalexin

  • First synonym: Camalexin

  • Synonyms: Camalexin,135531-86-1,3-(1,3-thiazol-2-yl)-1H-indole,2-(1H-indol-3-yl)-1,3-thiazole,3-(thiazol-2-yl)indole,CHEBI:22990,(2z)-2-Indol-3-Ylidene-3h-1,3-Thiazole,3-(2-thiazolyl)indole,2-(3-Indolyl)thiazole,3-thiazol-2'-yl-indole,3-thiazol-2-yl-1H-indole,SCHEMBL343413,CHEMBL239716,3-(Thiazol-2-yl)-1H-indole,Camalexin, >=98% (HPLC),1H-indole, 3-(2-thiazolyl)-,AOB1465,BCP33171,NSC804228,ZINC14766021,NSC-804228,AS-16652,HY-119502,CS-0068593,C21721,E75026,Q19903715,7WB

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Structure

  • Smiles: C1=CC=C2C(=C1)C(=CN2)C3=NC=CS3

  • Isomeric smiles: C1=CC=C2C(=C1)C(=CN2)C3=NC=CS3

  • Inchi: InChI=1S/C11H8N2S/c1-2-4-10-8(3-1)9(7-13-10)11-12-5-6-14-11/h1-7,13H

  • Inchikey: IYODIJVWGPRBGQ-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C11H8N2S

  • Molecular weight: 200.26

  • Monoisotopic mass: 200.04081944

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