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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > acetal > ketal > citrinal b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > acetal > ketal > citrinal b
... > 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 > acetal > ketal > citrinal b

Preferred term

citrinal b  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O5

inchi

  • InChI=1S/C15H22O5/c1-7-9(3)19-15-13(7)8(2)12(16)6-14(15,17)18-10(4)11(5)20-15/h7,9-11,17H,6H2,1-5H3/t7-,9-,10+,11+,14+,15-/m1/s1

inchikey

  • ZKJBPMKFQZIISQ-LCWPMPFFSA-N

mass

  • 282.336

monoisotopicmass

  • 282.14672

smiles

  • O=C1C(=C2[C@]3(O[C@@H](C)[C@@H](O[C@]3(C1)O)C)O[C@@H]([C@H]2C)C)C

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,4aS,8S,9R,10aR)-4a-hydroxy-2,3,7,8,9-pentamethyl-3,5,8,9-tetrahydro-2H-uro[3,2-i][1,4]benzodioxin-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211862

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