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Concept information

Preferred term

thioamycolamide c  

Type

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

charge

  • 0

formula

  • C22H31N3O3S2

inchi

  • InChI=1S/C22H31N3O3S2/c1-14(2)8-17-10-20(27)24-18(9-15-6-4-3-5-7-15)22-25-19(13-30-22)21(28)23-16(11-26)12-29-17/h3-7,14,16-19,26H,8-13H2,1-2H3,(H,23,28)(H,24,27)/t16-,17+,18+,19-/m1/s1

inchikey

  • MSOTXCHIMQMYDA-YDZRNGNQSA-N

mass

  • 449.630

monoisotopicmass

  • 449.18068

smiles

  • S1[C@H](CC(=O)N[C@H](C=2SC[C@H](C(N[C@@H](C1)CO)=O)N2)CC3=CC=CC=C3)CC(C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,4R,7S,11S)-11-benzyl-4-(hydroxymethyl)-7-(2-methylpropyl)-6,13-dithia-3,10,15-triazabicyclo[10.2.1]pentadec-12(15)-ene-2,9-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217117

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