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Concept information

Preferred term

آسپرنیگرین دی  

Type

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

charge

  • 0

formula

  • C33H32N2O8

inchi

  • InChI=1S/C33H32N2O8/c1-21(33(40)42-3)14-30(37)34-32(39)26-20-35(24(17-28(26)36)15-22-10-6-4-7-11-22)27(16-23-12-8-5-9-13-23)29-18-25(41-2)19-31(38)43-29/h4-13,17-21,27H,14-16H2,1-3H3,(H,34,37,39)/t21-,27-/m0/s1

inchikey

  • JPEFGJBPMMMOHN-IDISGSTGSA-N

mass

  • 584.625

monoisotopicmass

  • 584.21587

smiles

  • O=C1OC(=CC(=C1)OC)[C@@H](N2C(=CC(=O)C(=C2)C(=O)NC(=O)C[C@@H](C(=O)OC)C)CC3=CC=CC=C3)CC4=CC=CC=C4

subset

  • 2_STAR

synonym EXACT

  • methyl (2S)-4-[[6-benzyl-1-[(1S)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]-4-oxopyridine-3-carbonyl]amino]-2-methyl-4-oxobutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223789

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