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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 > decarboxydihydrocitrinone
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzoic acid > decarboxydihydrocitrinone
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzoic acid > decarboxydihydrocitrinone
organic aromatic compound > phenols > hydroxybenzoic acid > decarboxydihydrocitrinone
... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > decarboxydihydrocitrinone
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > decarboxydihydrocitrinone
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > decarboxydihydrocitrinone
... > 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 > decarboxydihydrocitrinone
organic aromatic compound > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > decarboxydihydrocitrinone

Preferred term

decarboxydihydrocitrinone  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14O4

inchi

  • InChI=1S/C12H14O4/c1-5-7(3)16-12(15)11-9(14)4-8(13)6(2)10(5)11/h4-5,7,13-14H,1-3H3/t5-,7-/m1/s1

inchikey

  • PPEPKULENIXILK-IYSWYEEDSA-N

mass

  • 222.240

monoisotopicmass

  • 222.08921

smiles

  • O=C1O[C@@H]([C@@H](C)C=2C1=C(O)C=C(O)C2C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,4S)-6,8-dihydroxy-3,4,5-trimethyl-3,4-dihydroisochromen-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203279

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