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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alcohol > tertiary alcohol > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alpha-hydroxy ketone > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alpha-hydroxy ketone > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
... > organooxygen compound > carbonyl compound > ketone > alpha-hydroxy ketone > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha-hydroxy ketone > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha-hydroxy ketone > tertiary alpha-hydroxy ketone > 4-amino-4-de(dimethylamino)anhydrotetracycline
organooxygen compound > polyketide > tetracyclines > 4-amino-4-de(dimethylamino)anhydrotetracycline

Preferred term

4-amino-4-de(dimethylamino)anhydrotetracycline  

Type

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

Broader concept

alt_id

  • CHEBI:134662
  • CHEBI:1818
  • CHEBI:20354

charge

  • 0

formula

  • C20H18N2O7

inchi

  • InChI=1S/C20H18N2O7/c1-6-7-3-2-4-10(23)11(7)15(24)12-8(6)5-9-14(21)16(25)13(19(22)28)18(27)20(9,29)17(12)26/h2-4,9,14,23-25,29H,5,21H2,1H3,(H2,22,28)/t9-,14-,20-/m0/s1

inchikey

  • INUFQOJZVFLXMQ-OWYOPICZSA-N

is_tautomer_of

mass

  • 398.367

monoisotopicmass

  • 398.11140

smiles

  • [C@@]12([C@](C(C3=C(C=4C(=CC=CC4C(=C3C1)C)O)O)=O)(C(C(C(N)=O)=C([C@H]2N)O)=O)O)[H]

subset

  • 3_STAR

synonym EXACT

  • (4S,4aS,12aS)-4-amino-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide

synonym RELATED

  • 4-amino-4-dedimethylamino-anhydrotetracycline
  • 4-amino-ATC
  • 4-Dedimethyl-6-dehydro-anhydrotetracycline
  • didesmethylanhydrotetracycline

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:28461

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