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Concept information

Preferred term

نوبیلامید دی  

Type

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

charge

  • 0

formula

  • C36H46N6O8

inchi

  • InChI=1S/C36H46N6O8/c1-7-26-36(49)50-22(5)30(35(48)41-29(20(2)3)34(47)37-21(4)31(44)39-26)42-33(46)28(19-25-16-12-9-13-17-25)40-32(45)27(38-23(6)43)18-24-14-10-8-11-15-24/h7-17,20-22,27-30H,18-19H2,1-6H3,(H,37,47)(H,38,43)(H,39,44)(H,40,45)(H,41,48)(H,42,46)/b26-7-/t21-,22+,27+,28-,29-,30+/m0/s1

inchikey

  • NUKXVWPUFGMEDK-MXUYVNIMSA-N

mass

  • 690.798

monoisotopicmass

  • 690.33771

smiles

  • O=C/1O[C@@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C)CC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)N[C@@H](C(C)C)C(N[C@H](C(N/C1=C/C)=O)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2R)-2-acetamido-N-[(2S)-1-[[(3Z,6S,9S,12R,13R)-3-ethylidene-6,13-dimethyl-2,5,8,11-tetraoxo-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridec-12-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:205492

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