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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > herbarumin iii
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > herbarumin iii
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > herbarumin iii
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > herbarumin iii

Preferred term

herbarumin iii  

Type

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

Broader concept

charge

  • 0

formula

  • C12H20O3

inchi

  • InChI=1S/C12H20O3/c1-2-6-11-9-10(13)7-4-3-5-8-12(14)15-11/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3/b7-4+/t10-,11+/m0/s1

inchikey

  • IWZXZFNLDPFUKQ-NAJRYUOPSA-N

mass

  • 212.289

monoisotopicmass

  • 212.14124

smiles

  • O=C1O[C@@H](C[C@@H](O)C=CCCC1)CCC

subset

  • 2_STAR

synonym EXACT

  • (2R,4R,5E)-4-hydroxy-2-propyl-2,3,4,7,8,9-hexahydrooxecin-10-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:205802

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