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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 > (1r,4s,5s,11r,14s,15s)-5,15-dihydroxy-1,11-bis(methylsulanyl)-18-oxa-3,13-diazapentacyclo[11.8.0.03,11.04,9.014,20]henicosa-6,8,16,19-tetraene-2,12-dione
organooxygen compound > (1r,4s,5s,11r,14s,15s)-5,15-dihydroxy-1,11-bis(methylsulanyl)-18-oxa-3,13-diazapentacyclo[11.8.0.03,11.04,9.014,20]henicosa-6,8,16,19-tetraene-2,12-dione

Preferred term

(1r,4s,5s,11r,14s,15s)-5,15-dihydroxy-1,11-bis(methylsulanyl)-18-oxa-3,13-diazapentacyclo[11.8.0.03,11.04,9.014,20]henicosa-6,8,16,19-tetraene-2,12-dione  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22N2O5S2

has_functional_parent

inchi

  • InChI=1S/C20H22N2O5S2/c1-28-19-8-11-4-3-5-13(23)15(11)21(19)18(26)20(29-2)9-12-10-27-7-6-14(24)16(12)22(20)17(19)25/h3-7,10,13-16,23-24H,8-9H2,1-2H3/t13-,14-,15-,16-,19+,20+/m0/s1

inchikey

  • AVDUYOJPBSBNCQ-PSJNWGMYSA-N

mass

  • 434.530

monoisotopicmass

  • 434.09701

smiles

  • S([C@@]12N(C(=O)[C@]3(SC)CC=4[C@H](N3C1=O)[C@@H](O)C=CC4)[C@@H]5[C@@H](O)C=COC=C5C2)C

subset

  • 2_STAR

synonym EXACT

  • (1R,4S,5S,11R,14S,15S)-5,15-dihydroxy-1,11-bis(methylsulanyl)-18-oxa-3,13-diazapentacyclo[11.8.0.03,11.04,9.014,20]henicosa-6,8,16,19-tetraene-2,12-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201328

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