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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > hydroxybenzoic acid > (r)-3-demethylpurpurester a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzoic acid > (r)-3-demethylpurpurester a
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzoic acid > (r)-3-demethylpurpurester a
organic aromatic compound > phenols > hydroxybenzoic acid > (r)-3-demethylpurpurester a
... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > (r)-3-demethylpurpurester a
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > (r)-3-demethylpurpurester a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > (r)-3-demethylpurpurester 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 > hydroxybenzoic acid > (r)-3-demethylpurpurester a
organic aromatic compound > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > (r)-3-demethylpurpurester a

Preferred term

(r)-3-demethylpurpurester a  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14O5

inchi

  • InChI=1S/C12H14O5/c1-3-4-12(16)7-5-8(13)10(14)6(2)9(7)11(15)17-12/h5,13-14,16H,3-4H2,1-2H3/t12-/m1/s1

inchikey

  • XKLHVAGRLHIBDJ-GFCCVEGCSA-N

mass

  • 238.239

monoisotopicmass

  • 238.08412

smiles

  • O=C1O[C@](O)(CCC)C=2C1=C(C(O)=C(O)C2)C

subset

  • 2_STAR

synonym EXACT

  • (3R)-3,5,6-trihydroxy-7-methyl-3-propyl-2-benzouran-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222189

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