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Chemistry, part 1

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 > (3s,6r)-3-[[4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl]methyl]-1,4-dimethyl-3,6-bis(methylsulanyl)piperazine-2,5-dione
organooxygen compound > (3s,6r)-3-[[4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl]methyl]-1,4-dimethyl-3,6-bis(methylsulanyl)piperazine-2,5-dione

Preferred term

(3s,6r)-3-[[4-[(2s)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl]methyl]-1,4-dimethyl-3,6-bis(methylsulanyl)piperazine-2,5-dione  

Type

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

Broader concept

charge

  • 0

formula

  • C21H32N2O5S2

has_functional_parent

inchi

  • InChI=1S/C21H32N2O5S2/c1-20(2,27-5)16(24)13-28-15-10-8-14(9-11-15)12-21(30-7)19(26)22(3)18(29-6)17(25)23(21)4/h8-11,16,18,24H,12-13H2,1-7H3/t16-,18+,21-/m0/s1

inchikey

  • WARDWSVNJGMQQK-CDXJDZJCSA-N

mass

  • 456.620

monoisotopicmass

  • 456.17526

smiles

  • S([C@@]1(N(C(=O)[C@@H](SC)N(C1=O)C)C)CC2=CC=C(OC[C@H](O)C(OC)(C)C)C=C2)C

subset

  • 2_STAR

synonym EXACT

  • (3S,6R)-3-[[4-[(2S)-2-hydroxy-3-methoxy-3-methylbutoxy]phenyl]methyl]-1,4-dimethyl-3,6-bis(methylsulanyl)piperazine-2,5-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206284

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