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Concept information

Preferred term

thiobinupharidine  

Type

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

Broader concept

charge

  • 0

formula

  • C30H42N2O2S

inchi

  • InChI=1S/C30H42N2O2S/c1-21-3-5-27(23-9-13-33-15-23)31-18-29(11-7-25(21)31)17-30(35-20-29)12-8-26-22(2)4-6-28(32(26)19-30)24-10-14-34-16-24/h9-10,13-16,21-22,25-28H,3-8,11-12,17-20H2,1-2H3/t21-,22-,25+,26+,27+,28+,29+,30+/m1/s1

inchikey

  • WBMOHCBEBDKSBI-JYZUVFRYSA-N

mass

  • 494.734

monoisotopicmass

  • 494.29670

smiles

  • C[C@@H]1CC[C@H](N2C[C@]3(CS[C@]4(C3)CC[C@H]3[C@H](C)CC[C@H](N3C4)c3ccoc3)CC[C@@H]12)c1ccoc1

subset

  • 2_STAR

synonym EXACT

  • Thiobinupharidine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:9548

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