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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > aiorsellinate a
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > aiorsellinate a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > aiorsellinate a
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > aiorsellinate a
organic aromatic compound > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > aiorsellinate a

Preferred term

aiorsellinate a  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O9

inchi

  • InChI=1S/C20H30O9/c1-10(2)5-6-12-13(23)7-11(3)16(18(12)28-4)20(27)29-19(15(25)9-22)17(26)14(24)8-21/h5,7,14-15,17,19,21-26H,6,8-9H2,1-4H3/t14-,15-,17-,19-/m1/s1

inchikey

  • KENUTGGSBUARDW-FXRXJOCMSA-N

mass

  • 414.451

monoisotopicmass

  • 414.18898

smiles

  • O=C(O[C@@H]([C@H](O)[C@H](O)CO)[C@H](O)CO)C1=C(OC)C(=C(O)C=C1C)CC=C(C)C

subset

  • 2_STAR

synonym EXACT

  • [(2R,3R,4R,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl] 4-hydroxy-2-methoxy-6-methyl-3-(3-methylbut-2-enyl)benzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224044

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