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Concept information

Preferred term

اسپیروکوستاتین A  

Type

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

charge

  • 0

formula

  • C20H31N3O6S2

inchi

  • InChI=1S/C20H31N3O6S2/c1-11(2)18-15(24)9-17(26)29-13-6-4-5-7-30-31-10-14(20(28)23-18)22-19(27)12(3)21-16(25)8-13/h4,6,11-15,18,24H,5,7-10H2,1-3H3,(H,21,25)(H,22,27)(H,23,28)/b6-4+/t12-,13?,14-,15?,18?/m1/s1

inchikey

  • XFLBOEMFLGLWFF-RCYPOCGFSA-N

mass

  • 473.600

monoisotopicmass

  • 473.16543

smiles

  • S1SCCC=CC2OC(=O)CC(C(NC([C@@H](C1)NC(=O)[C@H](NC(=O)C2)C)=O)C(C)C)O

subset

  • 2_STAR

synonym EXACT

  • (9S,15E,20R)-5-hydroxy-20-methyl-6-propan-2-yl-2-oxa-11,12-dithia-7,19,22-triazabicyclo[7.7.6]docos-15-ene-3,8,18,21-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204211

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