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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > fatty acid ester > aspergillusol a
organooxygen compound > carbonyl compound > carboxylic ester > fatty acid ester > aspergillusol a
... > 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 > carboxylic ester > fatty acid ester > aspergillusol a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > aspergillusol a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty acid ester > aspergillusol a

Preferred term

aspergillusol a  

Type

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

Broader concept

charge

  • 0

formula

  • C22H24N2O10

inchi

  • InChI=1S/C22H24N2O10/c25-15-5-1-13(2-6-15)9-17(23-31)21(29)33-11-19(27)20(28)12-34-22(30)18(24-32)10-14-3-7-16(26)8-4-14/h1-8,19-20,25-28,31-32H,9-12H2/b23-17+,24-18+/t19-,20+

inchikey

  • BXRQJOBHKCDAJW-VYKMKSEPSA-N

mass

  • 476.438

monoisotopicmass

  • 476.14309

smiles

  • O=C(OC[C@H](O)[C@H](O)COC(=O)/C(=N/O)/CC1=CC=C(O)C=C1)/C(=N/O)/CC2=CC=C(O)C=C2

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R)-2,3-dihydroxy-4-[(2E)-2-hydroxyimino-3-(4-hydroxyphenyl)propanoyl]oxybutyl] (2E)-2-hydroxyimino-3-(4-hydroxyphenyl)propanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209327

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