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Chemistry, part 2

Content language

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Concept information

organooxygen compound > polyketide > tetracyclines > eravacycline

Preferred term

eravacycline  

Type

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

Broader concept

charge

  • 0

formula

  • C27H31FN4O8

inchi

  • InChI=1S/C27H31FN4O8/c1-31(2)20-13-8-11-7-12-14(28)9-15(30-16(33)10-32-5-3-4-6-32)21(34)18(12)22(35)17(11)24(37)27(13,40)25(38)19(23(20)36)26(29)39/h9,11,13,20,34-35,38,40H,3-8,10H2,1-2H3,(H2,29,39)(H,30,33)/t11-,13-,20-,27-/m0/s1

inchikey

  • AKLMFDDQCHURPW-ISIOAQNYSA-N

mass

  • 558.563

monoisotopicmass

  • 558.21259

smiles

  • FC1=C2C[C@]3(C[C@@]4([C@](O)(C(=O)C3=C(O)C2=C(O)C(NC(=O)CN5CCCC5)=C1)C(O)=C(C(=O)[C@H]4N(C)C)C(=O)N)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • (4S,4aS,5aR,12aR)-4-(dimethylamino)-7-luoro-1,10,11,12a-tetrahydroxy-3,12-dioxo-9-[(2-pyrrolidin-1-ylacetyl)amino]-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177804

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