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Content language

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Concept information

Preferred term

Bu 2470 B1  

Type

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

Broader concept

charge

  • 0

formula

  • C52H91N13O10

inchi

  • InChI=1S/C52H91N13O10/c1-7-33(6)13-11-12-16-35(66)30-44(67)58-36(17-22-53)46(69)62-40-21-26-57-45(68)41(27-31(2)3)63-48(71)38(19-24-55)59-47(70)37(18-23-54)61-51(74)42(28-32(4)5)64-52(75)43(29-34-14-9-8-10-15-34)65-49(72)39(20-25-56)60-50(40)73/h8-10,14-15,31-33,35-43,66H,7,11-13,16-30,53-56H2,1-6H3,(H,57,68)(H,58,67)(H,59,70)(H,60,73)(H,61,74)(H,62,69)(H,63,71)(H,64,75)(H,65,72)

inchikey

  • LJOLGHKSWJYWDB-UHFFFAOYSA-N

mass

  • 1058.381

monoisotopicmass

  • 1057.70119

smiles

  • O=C1NC(C(=O)NC(C(=O)NC(C(=O)NC(CCN)C(NC(C(NC(C(NCCC1NC(=O)C(NC(=O)CC(O)CCCCC(CC)C)CCN)=O)CC(C)C)=O)CCN)=O)CC(C)C)CC2=CC=CC=C2)CCN

subset

  • 2_STAR

synonym EXACT

  • N-[4-amino-1-oxo-1-[[6,9,18-tris(2-aminoethyl)-15-benzyl-3,12-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]-3-hydroxy-8-methyldecanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223036

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