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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > cyclic peptide > citrusin iii
organooxygen compound > carboxamide > peptide > cyclic peptide > citrusin iii
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > cyclic peptide > citrusin iii
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > cyclic peptide > citrusin iii
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > cyclic peptide > citrusin iii

Preferred term

citrusin iii  

Type

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

Broader concept

charge

  • 0

formula

  • C36H53N7O9

inchi

  • InChI=1S/C36H53N7O9/c1-20(2)15-24-32(48)41-26(16-21(3)4)35(51)42-13-5-7-28(42)34(50)40-25(17-22-9-11-23(45)12-10-22)31(47)37-18-30(46)38-27(19-44)36(52)43-14-6-8-29(43)33(49)39-24/h9-12,20-21,24-29,44-45H,5-8,13-19H2,1-4H3,(H,37,47)(H,38,46)(H,39,49)(H,40,50)(H,41,48)

inchikey

  • JXSBDUVWEXYABO-UHFFFAOYSA-N

mass

  • 727.860

monoisotopicmass

  • 727.39048

smiles

  • O=C1N2C(CCC2)C(=O)NC(CC3=CC=C(O)C=C3)C(=O)NCC(=O)NC(C(=O)N4C(CCC4)C(=O)NC(CC(C)C)C(=O)NC1CC(C)C)CO

subset

  • 2_STAR

synonym EXACT

  • 15-(hydroxymethyl)-21-[(4-hydroxyphenyl)methyl]-3,6-bis(2-methylpropyl)-1,4,7,13,16,19,22-heptazatricyclo[22.3.0.09,13]heptacosane-2,5,8,14,17,20,23-heptone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231088

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