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Concept information

organooxygen compound > ether > aromatic ether > methoxybenzenes > 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > 3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine

Preferred term

3-(3-hydroxy-4-methoxybenzyl)-6-isobutyl-2,5-diketopiperazine  

Type

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

Broader concept

charge

  • 0

formula

  • C16H22N2O4

inchi

  • InChI=1S/C16H22N2O4/c1-9(2)6-11-15(20)18-12(16(21)17-11)7-10-4-5-14(22-3)13(19)8-10/h4-5,8-9,11-12,19H,6-7H2,1-3H3,(H,17,21)(H,18,20)/t11-,12-/m1/s1

inchikey

  • UAAHEUFOBRJXPN-VXGBXAGGSA-N

mass

  • 306.362

monoisotopicmass

  • 306.15796

smiles

  • O=C1N[C@@H](C(=O)N[C@@H]1CC2=CC(O)=C(OC)C=C2)CC(C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,6R)-3-[(3-hydroxy-4-methoxyphenyl)methyl]-6-(2-methylpropyl)piperazine-2,5-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204108

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