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Concept information

Preferred term

Ncp E2  

Type

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

Broader concept

charge

  • 0

formula

  • C36H54N8O9

inchi

  • InChI=1S/C36H54N8O9/c1-5-21(4)31-35(52)42-27(19-45)36(53)44-14-6-7-28(44)34(51)40-23(15-20(2)3)17-38-26(16-22-8-10-24(46)11-9-22)32(49)39-18-30(48)41-25(33(50)43-31)12-13-29(37)47/h8-11,17,20-21,23,25-28,31,45-46H,5-7,12-16,18-19H2,1-4H3,(H2,37,47)(H,39,49)(H,40,51)(H,41,48)(H,42,52)(H,43,50)

inchikey

  • RDSXOMRMGOPDCR-UHFFFAOYSA-N

mass

  • 742.875

monoisotopicmass

  • 742.40138

smiles

  • O=C1N2C(C(=O)NC(C=NC(C(=O)NCC(NC(C(NC(C(NC1CO)=O)C(CC)C)=O)CCC(=O)N)=O)CC3=CC=C(O)C=C3)CC(C)C)CCC2

subset

  • 2_STAR

synonym EXACT

  • 3-[6-butan-2-yl-3-(hydroxymethyl)-15-[(4-hydroxyphenyl)methyl]-18-(2-methylpropyl)-2,5,8,11,14,20-hexaoxo-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracos-16-en-9-yl]propanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210366

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