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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 > tyrosine derivative > (3r,5s)-5-(4-hydroxybenzyl)-3-methyl-3-((2e,4e,6e,8e,10e)-4,8,10-trimethyldodeca-2,4,6,8,10-pentaenoyl)pyrrolidine-2,4-dione
... > 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 > tyrosine derivative > (3r,5s)-5-(4-hydroxybenzyl)-3-methyl-3-((2e,4e,6e,8e,10e)-4,8,10-trimethyldodeca-2,4,6,8,10-pentaenoyl)pyrrolidine-2,4-dione

Preferred term

(3r,5s)-5-(4-hydroxybenzyl)-3-methyl-3-((2e,4e,6e,8e,10e)-4,8,10-trimethyldodeca-2,4,6,8,10-pentaenoyl)pyrrolidine-2,4-dione  

Type

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

Broader concept

charge

  • 0

formula

  • C27H33NO5

inchi

  • InChI=1S/C27H33NO5/c1-6-18(2)16-20(4)9-7-8-19(3)10-15-25(30)21(5)26(31)28-24(27(32)33)17-22-11-13-23(29)14-12-22/h6-16,21,24,29H,17H2,1-5H3,(H,28,31)(H,32,33)/b9-7+,15-10+,18-6+,19-8+,20-16+/t21?,24-/m1/s1

inchikey

  • QYOOOQHFZSDPSQ-WNZXBQPCSA-N

mass

  • 451.563

monoisotopicmass

  • 451.23587

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2R)-3-(4-hydroxyphenyl)-2-[[(4E,6E,8E,10E,12E)-2,6,10,12-tetramethyl-3-oxotetradeca-4,6,8,10,12-pentaenoyl]amino]propanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221940

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