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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > isariotin k
... > 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 > cyclic ketone > alicyclic ketone > cyclohexenones > isariotin k
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > isariotin k

Preferred term

isariotin k  

Type

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

Broader concept

charge

  • 0

formula

  • C19H27NO5

inchi

  • InChI=1S/C19H27NO5/c1-2-3-4-5-6-7-8-9-16(22)20-13-12-19(25-18(13)23)15(21)11-10-14-17(19)24-14/h8-11,13-14,17-18,23H,2-7,12H2,1H3,(H,20,22)/b9-8+/t13-,14-,17-,18+,19+/m0/s1

inchikey

  • UPQMGPGUBWPRQV-ZGHCVQBBSA-N

mass

  • 349.427

monoisotopicmass

  • 349.18892

smiles

  • O=C1C=C[C@H]2[C@@H]([C@]13O[C@@H](O)[C@H](C3)NC(=O)/C=C/CCCCCCC)O2

subset

  • 2_STAR

synonym EXACT

  • (E)-N-[(1S,2'R,3'S,5S,6S)-2'-hydroxy-4-oxospiro[7-oxabicyclo[4.1.0]hept-2-ene-5,5'-oxolane]-3'-yl]dec-2-enamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212712

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