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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 > amino-acid derivative > phenylalanine derivative > holrhizin i

Preferred term

holrhizin i  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30N2O4

inchi

  • InChI=1S/C20H30N2O4/c1-4-5-7-12-17(23)22-18(14(2)3)19(24)21-16(20(25)26)13-15-10-8-6-9-11-15/h6,8-11,14,16,18H,4-5,7,12-13H2,1-3H3,(H,21,24)(H,22,23)(H,25,26)/t16-,18-/m0/s1

inchikey

  • AJCVVWOPACTCCN-WMZOPIPTSA-N

mass

  • 362.470

monoisotopicmass

  • 362.22056

smiles

  • O=C(O)[C@@H](NC(=O)[C@@H](NC(=O)CCCCC)C(C)C)CC1=CC=CC=C1

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-2-(hexanoylamino)-3-methylbutanoyl]amino]-3-phenylpropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223788

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