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Concept information

Preferred term

resormycin  

Type

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

Broader concept

charge

  • 0

formula

  • C21H31ClN4O7

inchi

  • InChI=1S/C21H31ClN4O7/c1-21(2,33)18(26-16(29)10-12(24)5-3-4-6-23)19(30)25-13(20(31)32)7-11-8-14(27)17(22)15(28)9-11/h7-9,12,18,27-28,33H,3-6,10,23-24H2,1-2H3,(H,25,30)(H,26,29)(H,31,32)/b13-7-/t12-,18+/m0/s1

inchikey

  • LGIARSLOMQCKGX-SMOPJJOVSA-N

mass

  • 486.950

monoisotopicmass

  • 486.18813

smiles

  • ClC1=C(O)C=C(/C=C(/NC(=O)[C@@H](NC(=O)C[C@@H](N)CCCCN)C(O)(C)C)/C(=O)O)C=C1O

subset

  • 2_STAR

synonym EXACT

  • (Z)-3-(4-chloro-3,5-dihydroxyphenyl)-2-[[(2S)-2-[[(3S)-3,7-diaminoheptanoyl]amino]-3-hydroxy-3-methylbutanoyl]amino]prop-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199392

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