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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > epitalon

Preferred term

epitalon  

Type

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

Broader concept

charge

  • 0

formula

  • C14H22N4O9

inchi

  • InChI=1S/C14H22N4O9/c1-6(15)12(25)17-7(2-3-9(19)20)14(27)18-8(4-10(21)22)13(26)16-5-11(23)24/h6-8H,2-5,15H2,1H3,(H,16,26)(H,17,25)(H,18,27)(H,19,20)(H,21,22)(H,23,24)/t6-,7-,8-/m0/s1

inchikey

  • HGHOBRRUMWJWCU-FXQIFTODSA-N

mass

  • 390.349

monoisotopicmass

  • 390.13868

smiles

  • O=C(N[C@@H](CC(O)=O)C(=O)NCC(O)=O)[C@@H](NC(=O)[C@@H](N)C)CCC(O)=O

subset

  • 2_STAR

synonym EXACT

  • (4S)-4-[[(2S)-2-aminopropanoyl]amino]-5-[[(2S)-3-carboxy-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230091

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