skip to main content

Chemistry, part 1

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > 4,6-secoangustilobinal a
organooxygen compound > 4,6-secoangustilobinal a

Preferred term

4,6-secoangustilobinal a  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22N2O4

has_functional_parent

has_role

inchi

  • InChI=1S/C20H22N2O4/c1-3-19-11-21-9-8-16(19)20(12-26-19,18(24)25-2)17-14(10-23)13-6-4-5-7-15(13)22-17/h3-7,10,16,21-22H,1,8-9,11-12H2,2H3/t16-,19+,20-/m0/s1

inchikey

  • NYHDCCXVPFWHFN-DBVUQKKJSA-N

mass

  • 354.39970

monoisotopicmass

  • 354.15796

smiles

  • [H][C@]12CCNC[C@]1(OC[C@@]2(C(=O)OC)c1[nH]c2ccccc2c1C=O)C=C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70503

Download this concept:

RDF/XML TURTLE JSON-LD