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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 > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > leucine derivative > sodium;(2s)-2-[[(2s)-2-[(1-ethoxycarbonylpiperidin-4-yl)oxycarbonylamino]-4-methylpentanoyl]amino]-1-hydroxy-3-[(3s)-2-oxopyrrolidin-3-yl]propane-1-sulfonate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organonitrogen compound > amino-acid derivative > leucine derivative > sodium;(2s)-2-[[(2s)-2-[(1-ethoxycarbonylpiperidin-4-yl)oxycarbonylamino]-4-methylpentanoyl]amino]-1-hydroxy-3-[(3s)-2-oxopyrrolidin-3-yl]propane-1-sulfonate

Preferred term

sodium;(2s)-2-[[(2s)-2-[(1-ethoxycarbonylpiperidin-4-yl)oxycarbonylamino]-4-methylpentanoyl]amino]-1-hydroxy-3-[(3s)-2-oxopyrrolidin-3-yl]propane-1-sulfonate  

Type

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

Broader concept

charge

  • 0

formula

  • C22H37N4O10S.Na

has_role

inchi

  • InChI=1S/C22H38N4O10S.Na/c1-4-35-22(31)26-9-6-15(7-10-26)36-21(30)25-16(11-13(2)3)19(28)24-17(20(29)37(32,33)34)12-14-5-8-23-18(14)27;/h13-17,20,29H,4-12H2,1-3H3,(H,23,27)(H,24,28)(H,25,30)(H,32,33,34);/q;+1/p-1/t14-,16-,17-,20?;/m0./s1

inchikey

  • FTLUCMWMNGOWPX-OPOLGWMESA-M

mass

  • 572.610

monoisotopicmass

  • 572.21281

smiles

  • [Na+].O=S(=O)(C([C@H](C[C@H]1C(NCC1)=O)NC([C@H](CC(C)C)NC(=O)OC2CCN(CC2)C(=O)OCC)=O)O)[O-]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:149926

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