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

Preferred term

pestaphthalide b  

Type

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

Broader concept

charge

  • 0

formula

  • C11H12O5

inchi

  • InChI=1S/C11H12O5/c1-4-7(13)3-6-8(9(4)14)11(15)16-10(6)5(2)12/h3,5,10,12-14H,1-2H3/t5-,10-/m0/s1

inchikey

  • GRSVIXWYIHCOGF-RRAGMBSWSA-N

mass

  • 224.212

monoisotopicmass

  • 224.06847

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (3R)-5,7-dihydroxy-3-[(1S)-1-hydroxyethyl]-6-methyl-3H-2-benzouran-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198638

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