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Concept information

Preferred term

ochralate a  

Type

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

Broader concept

charge

  • 0

formula

  • C39H63AlN6O9

inchi

  • InChI=1S/3C13H21N2O3.Al/c3*1-8(2)6-10-7-14-11(13(16)15(10)17)12(18-5)9(3)4;/h3*7-9,12H,6H2,1-5H3;/q3*-1;+3

inchikey

  • NIOMLBSDKVTYNL-UHFFFAOYSA-N

mass

  • 786.948

monoisotopicmass

  • 786.44719

smiles

  • [Al](ON1C(=O)C(=NC=C1CC(C)C)C(OC)C(C)C)(ON2C(=O)C(=NC=C2CC(C)C)C(OC)C(C)C)ON3C(=O)C(=NC=C3CC(C)C)C(OC)C(C)C

subset

  • 2_STAR

synonym EXACT

  • 1-bis[[3-(1-methoxy-2-methylpropyl)-6-(2-methylpropyl)-2-oxopyrazin-1-yl]oxy]alumanyloxy-3-(1-methoxy-2-methylpropyl)-6-(2-methylpropyl)pyrazin-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218612

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