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Concept information

Preferred term

آنتیمایسین A19  

Type

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

charge

  • 0

formula

  • C28H40N2O9

inchi

  • InChI=1S/C28H40N2O9/c1-7-8-9-11-20-24(39-26(34)16(4)15(2)3)18(6)38-28(36)22(17(5)37-27(20)35)30-25(33)19-12-10-13-21(23(19)32)29-14-31/h10,12-18,20,22,24,32H,7-9,11H2,1-6H3,(H,29,31)(H,30,33)/t16-,17+,18-,20+,22-,24-/m0/s1

inchikey

  • FKJLKGUXRIDXTL-UKHQZXFMSA-N

mass

  • 548.633

monoisotopicmass

  • 548.27338

smiles

  • O=C1O[C@H]([C@H](OC(=O)[C@H](C(C)C)C)[C@@H](CCCCC)C(O[C@@H]([C@@H]1NC(=O)C2=C(O)C(NC=O)=CC=C2)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • [(2R,3S,6S,7R,8R)-3-[(3-ormamido-2-hydroxybenzoyl)amino]-2,6-dimethyl-4,9-dioxo-8-pentyl-1,5-dioxonan-7-yl] (2S)-2,3-dimethylbutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199857

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