skip to main content

Chemistry, part 2

Content language

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

Concept information

organooxygen compound > oxacycle > benzofurans > 2-benzofurans > phomopsiketone a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > phomopsiketone a
... > 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 > benzofurans > 2-benzofurans > phomopsiketone a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > phomopsiketone a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > phomopsiketone a
... > 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 > organic heteropolycyclic compound > benzofurans > 2-benzofurans > phomopsiketone a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > phomopsiketone a

Preferred term

phomopsiketone a  

Type

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

Broader concept

charge

  • 0

formula

  • C12H18O5

inchi

  • InChI=1S/C12H18O5/c1-2-3-7(13)12-10-6(5-17-12)8(14)4-9(15)11(10)16/h7,9,11-13,15-16H,2-5H2,1H3/t7-,9+,11+,12-/m1/s1

inchikey

  • FUHFXQFCROOSEZ-NYBSVBNRSA-N

mass

  • 242.271

monoisotopicmass

  • 242.11542

smiles

  • O=C1C2=C([C@@H](O)[C@H](C1)O)[C@@H]([C@H](O)CCC)OC2

subset

  • 2_STAR

synonym EXACT

  • (1S,6S,7R)-6,7-dihydroxy-1-[(1R)-1-hydroxybutyl]-3,5,6,7-tetrahydro-1H-2-benzouran-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210868

Download this concept:

RDF/XML TURTLE JSON-LD