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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 23-o-acetyl-n-hydroxyapiosporamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 23-o-acetyl-n-hydroxyapiosporamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 23-o-acetyl-n-hydroxyapiosporamide
... > 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 > aromatic ketone > 23-o-acetyl-n-hydroxyapiosporamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 23-o-acetyl-n-hydroxyapiosporamide

Preferred term

23-o-acetyl-n-hydroxyapiosporamide  

Type

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

Broader concept

charge

  • 0

formula

  • C26H33NO8

inchi

  • InChI=1S/C26H33NO8/c1-12-4-7-16-15(10-12)6-5-13(2)19(16)22(30)20-21(29)17(11-27(33)25(20)31)26(32)9-8-18(34-14(3)28)23-24(26)35-23/h5-6,11-13,15-16,18-19,23-24,29,32-33H,4,7-10H2,1-3H3/t12-,13-,15-,16-,18-,19-,23-,24-,26+/m1/s1

inchikey

  • XJGASSGRQMFKDJ-RYRIJOLQSA-N

mass

  • 487.549

monoisotopicmass

  • 487.22062

smiles

  • O=C1N(O)C=C([C@]2(O)[C@@H]3O[C@@H]3[C@H](OC(=O)C)CC2)C(=C1C(=O)[C@H]4[C@H]5[C@H](C=C[C@H]4C)C[C@H](C)CC5)O

subset

  • 2_STAR

synonym EXACT

  • [(1R,2R,5S,6R)-5-[5-[(1R,2R,4aS,6R,8aR)-2,6-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-1,4-dihydroxy-6-oxopyridin-3-yl]-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217499

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