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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 > cyclomarazine b
organooxygen compound > cyclomarazine b

Preferred term

cyclomarazine b  

Type

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

Broader concept

charge

  • 0

formula

  • C22H29N3O3

has_functional_parent

inchi

  • InChI=1S/C22H29N3O3/c1-5-22(3,4)25-12-15(16-8-6-7-9-19(16)25)11-18-21(28)23-17(20(27)24-18)10-14(2)13-26/h5-9,12,14,17-18,26H,1,10-11,13H2,2-4H3,(H,23,28)(H,24,27)/t14-,17+,18+/m1/s1

inchikey

  • RDOMJBDZWXNXPA-JLSDUUJJSA-N

mass

  • 383.492

monoisotopicmass

  • 383.22089

smiles

  • O=C1N[C@H](C(=O)N[C@H]1CC=2C3=C(C=CC=C3)N(C2)C(C=C)(C)C)C[C@H](CO)C

subset

  • 2_STAR

synonym EXACT

  • (3S,6S)-3-[(2R)-3-hydroxy-2-methylpropyl]-6-[[1-(2-methylbut-3-en-2-yl)indol-3-yl]methyl]piperazine-2,5-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203114

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