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Chemistry, part 2

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > hydroxy fatty acid ascaroside > (omega-1)-hydroxy fatty acid ascaroside > ascr#27
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > ascaroside > hydroxy fatty acid ascaroside > (omega-1)-hydroxy fatty acid ascaroside > ascr#27
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > deoxy hexoside > ascaroside > hydroxy fatty acid ascaroside > (omega-1)-hydroxy fatty acid ascaroside > ascr#27

Preferred term

ascr#27  

Type

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

Broader concept

charge

  • 0

formula

  • C22H40O6

has_functional_parent

has_role

inchi

  • InChI=1S/C22H40O6/c1-17(27-22-20(24)16-19(23)18(2)28-22)14-12-10-8-6-4-3-5-7-9-11-13-15-21(25)26/h13,15,17-20,22-24H,3-12,14,16H2,1-2H3,(H,25,26)/b15-13+/t17-,18+,19-,20-,22-/m1/s1

inchikey

  • PHSQDXKUQRUWOG-PXMSNCRXSA-N

is_conjugate_acid_of

mass

  • 400.54940

monoisotopicmass

  • 400.28249

smiles

  • C[C@H](CCCCCCCCCCC/C=C/C(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O

subset

  • 3_STAR

synonym EXACT

  • (2E,15R)-15-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]hexadec-2-enoic acid

synonym RELATED

  • 15R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-2E-hexadecenoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:78965

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