skip to main content

Chemistry, part 2

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > pinnatifidone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > pinnatifidone

Preferred term

pinnatifidone  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22BrClO2

inchi

  • InChI=1S/C15H22BrClO2/c1-8-9(18)5-11-13(2,3)15(8)6-10(16)14(4,17)7-12(15)19-11/h8,10-12H,5-7H2,1-4H3

inchikey

  • AMBZPRYSLXAMTB-UHFFFAOYSA-N

mass

  • 349.690

monoisotopicmass

  • 348.04917

smiles

  • BrC1C(Cl)(CC2OC3C(C2(C1)C(C(=O)C3)C)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • 3-bromo-4-chloro-4,11,12,12-tetramethyl-7-oxatricyclo[6.3.1.01,6]dodecan-10-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200213

Download this concept:

RDF/XML TURTLE JSON-LD