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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 > lsm-5254
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > lsm-5254

Preferred term

lsm-5254  

Type

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

Broader concept

charge

  • 0

formula

  • C11H16O4

inchi

  • InChI=1S/C11H16O4/c1-3-7(13)11-9(15-11)5-4-8-10(14-8)6(2)12/h3-13H,1H2,2H3/t6-,7-,8+,9-,10-,11+/m1/s1

inchikey

  • DLVJMFOLJOOWFS-PMXSCFQLSA-N

mass

  • 212.243

monoisotopicmass

  • 212.10486

smiles

  • C[C@H]([C@@H]1[C@@H](O1)C=C[C@@H]2[C@@H](O2)[C@@H](C=C)O)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:94491

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