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Chemistry, part 2

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 > alcohol > secondary alcohol > asperaculane b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > asperaculane b

Preferred term

asperaculane b  

Type

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

Broader concept

charge

  • 0

formula

  • C14H20O3

inchi

  • InChI=1S/C14H20O3/c1-3-10-7-13(17)14(2)11(10)5-4-9(8-15)6-12(14)16/h4,7,11-12,15-16H,3,5-6,8H2,1-2H3/t11-,12+,14-/m1/s1

inchikey

  • GFYHPKUYDFUKNL-MBNYWOFBSA-N

mass

  • 236.311

monoisotopicmass

  • 236.14124

smiles

  • O=C1C=C(CC)[C@@H]2[C@@]1([C@@H](O)CC(CO)=CC2)C

subset

  • 2_STAR

synonym EXACT

  • (3aR,8S,8aR)-3-ethyl-8-hydroxy-6-(hydroxymethyl)-8a-methyl-3a,4,7,8-tetrahydroazulen-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209882

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