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Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > aromatic ketone > pyrenochaetic acid g
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > pyrenochaetic acid g
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > pyrenochaetic acid g
... > 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 > ketone > aromatic ketone > pyrenochaetic acid g
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > pyrenochaetic acid g

Preferred term

pyrenochaetic acid g  

Type

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

Broader concept

charge

  • 0

formula

  • C13H16O5

inchi

  • InChI=1S/C13H16O5/c1-4-9(14)12(15)11-7(2)5-8(13(16)17)6-10(11)18-3/h5-6,9,14H,4H2,1-3H3,(H,16,17)/t9-/m0/s1

inchikey

  • DYNJXWQSYFQHGS-VIFPVBQESA-N

mass

  • 252.266

monoisotopicmass

  • 252.09977

smiles

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

subset

  • 2_STAR

synonym EXACT

  • 4-[(2S)-2-hydroxybutanoyl]-3-methoxy-5-methylbenzoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197834

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