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Concept information

Preferred term

3 epi 3 hydroxymugineate (2)  

Type

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

charge

  • -2

formula

  • C12H18N2O9

inchi

  • InChI=1S/C12H20N2O9/c15-5(10(18)19)1-2-13-8(11(20)21)6(16)3-14-4-7(17)9(14)12(22)23/h5-9,13,15-17H,1-4H2,(H,18,19)(H,20,21)(H,22,23)/p-2/t5-,6-,7-,8-,9-/m0/s1

inchikey

  • QPIOQLJXMZWNFJ-LJASKYJCSA-L

mass

  • 334.27930

monoisotopicmass

  • 334.10233

smiles

  • O[C@@H](CN1C[C@H](O)[C@H]1C([O-])=O)[C@H]([NH2+]CC[C@H](O)C([O-])=O)C([O-])=O

subset

  • 3_STAR

synonym EXACT

  • (2S,3S)-1-[(2S,3S)-3-carboxylato-3-{[(3S)-3-carboxylato-3-hydroxypropyl]ammonio}-2-hydroxypropyl]-3-hydroxyazetidine-2-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:58488

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