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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > allopumiliotoxin 267a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organonitrogen compound > alkaloid > allopumiliotoxin 267a

Preferred term

allopumiliotoxin 267a  

Type

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

Broader concept

charge

  • 0

formula

  • C16H29NO2

inchi

  • InChI=1S/C16H29NO2/c1-4-5-7-12(2)10-13-11-17-9-6-8-14(17)16(3,19)15(13)18/h10,12,14-15,18-19H,4-9,11H2,1-3H3/b13-10+/t12-,14+,15-,16-/m1/s1

inchikey

  • LWXKAVPXEDNHLL-VRUXTKGDSA-N

mass

  • 267.413

monoisotopicmass

  • 267.21983

smiles

  • O[C@@]1([C@]2(N(CCC2)C/C(/[C@H]1O)=C/[C@@H](CCCC)C)[H])C

subset

  • 2_STAR

synonym EXACT

  • (6E,7R,8R,8aS)-8-methyl-6-[(2R)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:182171

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