skip to main content

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 > (5s)-6-hydroxy-5-isopropenyl-2-methylhexanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > (5s)-6-hydroxy-5-isopropenyl-2-methylhexanoate
... > 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 > (5s)-6-hydroxy-5-isopropenyl-2-methylhexanoate
... > 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 > (5s)-6-hydroxy-5-isopropenyl-2-methylhexanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > (5s)-6-hydroxy-5-isopropenyl-2-methylhexanoate

Preferred term

(5s)-6-hydroxy-5-isopropenyl-2-methylhexanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C10H17O3

inchi

  • InChI=1S/C10H18O3/c1-7(2)9(6-11)5-4-8(3)10(12)13/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)/t8?,9-/m0/s1

inchikey

  • QJXGZJIBSSFJPK-GKAPJAKFSA-N

mass

  • 186.249

monoisotopicmass

  • 186.12559

smiles

  • CC(CC[C@@H](CO)C(C)=C)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • (5S)-6-Hydroxy-5-isopropenyl-2-methylhexanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:242

Download this concept:

RDF/XML TURTLE JSON-LD