skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

organooxygen compound > oxacycle > herbarumin i
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > herbarumin i
... > 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 i
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > herbarumin i

Preferred term

herbarumin i  

Type

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

Broader concept

charge

  • 0

formula

  • C12H20O4

inchi

  • InChI=1S/C12H20O4/c1-2-6-10-12(15)9(13)7-4-3-5-8-11(14)16-10/h4,7,9-10,12-13,15H,2-3,5-6,8H2,1H3/b7-4-/t9-,10+,12-/m0/s1

inchikey

  • IZFXFVSOQMEZKB-RVUUCJLMSA-N

mass

  • 228.288

monoisotopicmass

  • 228.13616

smiles

  • O=C1O[C@@H]([C@@H](O)[C@@H](O)C=CCCC1)CCC

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222000

Download this concept:

RDF/XML TURTLE JSON-LD