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Concept information

Preferred term

ایزوتراندامایسین B  

Type

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

Broader concept

charge

  • 0

formula

  • C22H27NO8

inchi

  • InChI=1S/C22H27NO8/c1-10(5-6-13(25)15-14(26)8-23-20(15)28)7-11(2)17-12(3)18-16(27)19-22(9-24,31-19)21(4,29-17)30-18/h5-7,11-12,17-19,24-25H,8-9H2,1-4H3,(H,23,28)/t11-,12-,17-,18+,19+,21+,22+/m1/s1

inchikey

  • LYJKREGDQDJIDC-RXSAWIGCSA-N

mass

  • 433.457

monoisotopicmass

  • 433.17367

smiles

  • O=C1[C@H]2O[C@@](O[C@@H]([C@H]2C)[C@@H](C=C(C=CC(O)=C3C(=O)NCC3=O)C)C)(C)[C@@]4([C@H]1O4)CO

subset

  • 2_STAR

synonym EXACT

  • 3-[(6R)-1-hydroxy-6-[(1S,2S,4R,6S,7R,8R)-2-(hydroxymethyl)-1,7-dimethyl-5-oxo-3,9,10-trioxatricyclo[4.3.1.02,4]decan-8-yl]-4-methylhepta-2,4-dienylidene]pyrrolidine-2,4-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222210

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