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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > epi-herbarumin ii
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > epi-herbarumin ii
... > 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 > epi-herbarumin ii
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > epi-herbarumin ii

Preferred term

epi-herbarumin ii  

Type

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

Broader concept

charge

  • 0

formula

  • C12H20O5

inchi

  • InChI=1S/C12H20O5/c1-2-5-10-11(15)8(13)6-3-4-7-9(14)12(16)17-10/h3,6,8-11,13-15H,2,4-5,7H2,1H3/b6-3-/t8-,9-,10+,11-/m0/s1

inchikey

  • KQJGPGHQDDZVHJ-AHLYJNKNSA-N

mass

  • 244.287

monoisotopicmass

  • 244.13107

smiles

  • O=C1O[C@@H]([C@@H](O)[C@@H](O)C=CCC[C@@H]1O)CCC

subset

  • 2_STAR

synonym EXACT

  • (2R,3S,4S,5Z,9S)-3,4,9-trihydroxy-2-propyl-2,3,4,7,8,9-hexahydrooxecin-10-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199453

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