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Concept information

Preferred term

subenniatin a  

Type

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

Broader concept

charge

  • 0

formula

  • C22H40N2O7

inchi

  • InChI=1S/C22H40N2O7/c1-11(2)15(21(28)29)23(9)20(27)18(14(7)8)31-22(30)16(12(3)4)24(10)19(26)17(25)13(5)6/h11-18,25H,1-10H3,(H,28,29)/t15-,16+,17+,18+/m0/s1

inchikey

  • DNNNUEHTBMXDJS-BSDSXHPESA-N

mass

  • 444.569

monoisotopicmass

  • 444.28355

smiles

  • O=C(O[C@@H](C(=O)N([C@H](C(=O)O)C(C)C)C)C(C)C)[C@H](N(C(=O)[C@H](O)C(C)C)C)C(C)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2R)-2-[(2R)-2-[[(2R)-2-hydroxy-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]oxy-3-methylbutanoyl]-methylamino]-3-methylbutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203168

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