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Concept information

Preferred term

erythrazole b  

Type

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

Broader concept

charge

  • 0

formula

  • C33H44N2O7S

inchi

  • InChI=1S/C33H44N2O7S/c1-21(9-6-10-22(2)12-8-14-24(4)16-18-28(36)37)11-7-13-23(3)15-17-25-30(40)27(42-5)19-26-31(25)43-33(35-26)32(41)34-20-29(38)39/h10-11,15-16,19,40H,6-9,12-14,17-18,20H2,1-5H3,(H,34,41)(H,36,37)(H,38,39)/b21-11+,22-10+,23-15+,24-16-

inchikey

  • ZYIFWTDXOSUKLM-QFIYVEOGSA-N

mass

  • 612.780

monoisotopicmass

  • 612.28692

smiles

  • S1C2=C(C(O)=C(OC)C=C2N=C1C(=O)NCC(=O)O)C/C=C(/CC/C=C(/CC/C=C(/CCC/C(=C/CC(=O)O)/C)/C)/C)/C

subset

  • 2_STAR

synonym EXACT

  • (3Z,8E,12E,16E)-18-[2-(carboxymethylcarbamoyl)-6-hydroxy-5-methoxy-1,3-benzothiazol-7-yl]-4,8,12,16-tetramethyloctadeca-3,8,12,16-tetraenoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212151

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