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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 > berkchaetoazaphilone b
... > 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 > berkchaetoazaphilone b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > berkchaetoazaphilone b

Preferred term

berkchaetoazaphilone b  

Type

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

Broader concept

charge

  • 0

formula

  • C25H32O7

inchi

  • InChI=1S/C25H32O7/c1-4-5-6-7-8-9-10-11-20(27)24-22(29)31-23(3)21(28)14-17-13-18(12-16(2)26)30-15-19(17)25(23,24)32-24/h13-16,26H,4-12H2,1-3H3/t16-,23-,24-,25+/m0/s1

inchikey

  • YEGUZQUADBNQFP-NBQXJWNKSA-N

mass

  • 444.524

monoisotopicmass

  • 444.21480

smiles

  • O=C1C=C2C(=COC(=C2)C[C@@H](O)C)[C@@]34[C@]1(OC(=O)[C@]3(C(=O)CCCCCCCCC)O4)C

subset

  • 2_STAR

synonym EXACT

  • (1R,10R,13S)-13-decanoyl-5-[(2S)-2-hydroxypropyl]-10-methyl-4,11,14-trioxatetracyclo[8.4.0.01,13.02,7]tetradeca-2,5,7-triene-9,12-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201090

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