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Chemistry, part 2

Content language

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Concept information

organooxygen compound > polyketide > tetracyclines > 5a,6-anhydrotetracycline

Preferred term

5a,6-anhydrotetracycline  

Type

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

Broader concept

charge

  • 0

formula

  • C22H22N2O7

inchi

  • InChI=1S/C22H22N2O7/c1-8-9-5-4-6-12(25)13(9)17(26)14-10(8)7-11-16(24(2)3)18(27)15(21(23)30)20(29)22(11,31)19(14)28/h4-6,11,16,25-26,29,31H,7H2,1-3H3,(H2,23,30)/t11-,16-,22-/m0/s1

inchikey

  • KTTKGQINVKPHLY-DOCRCCHOSA-N

mass

  • 426.425

monoisotopicmass

  • 426.14270

smiles

  • O[C@]12[C@]([C@H](N(C)C)C(=O)C(=C1O)C(=O)N)(CC3=C(C2=O)C(O)=C4C(=C3C)C=CC=C4O)[H]

subset

  • 2_STAR

synonym EXACT

  • (4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191005

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