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Chemistry, part 1

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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 > rubrumline c
organooxygen compound > rubrumline c

Preferred term

rubrumline c  

Type

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

Broader concept

charge

  • 0

formula

  • C26H33N3O5

has_functional_parent

inchi

  • InChI=1S/C26H33N3O5/c1-8-25(4,5)22-18(13-20-24(32)27-14(2)23(31)29-20)17-11-16(9-10-19(17)28-22)12-21(26(6,7)33)34-15(3)30/h8-11,13-14,21,28,33H,1,12H2,2-7H3,(H,27,32)(H,29,31)/b20-13-/t14-,21-/m0/s1

inchikey

  • VESAPIJMLQTAHA-SCICNIQYSA-N

mass

  • 467.566

monoisotopicmass

  • 467.24202

smiles

  • O=C/1N[C@H](C(=O)N/C1=C/C=2C3=C(C=CC(=C3)C[C@H](OC(=O)C)C(O)(C)C)NC2C(C=C)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • [(2S)-3-hydroxy-3-methyl-1-[2-(2-methylbut-3-en-2-yl)-3-[(Z)-[(5S)-5-methyl-3,6-dioxopiperazin-2-ylidene]methyl]-1H-indol-5-yl]butan-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217817

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