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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > dehydroprobetaenone i

Preferred term

dehydroprobetaenone i  

Type

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

Broader concept

charge

  • 0

formula

  • C21H34O2

inchi

  • InChI=1S/C21H34O2/c1-7-14(3)19-16(5)12-17-11-13(2)10-15(4)20(17)21(19,6)18(23)8-9-22/h8-9,12-15,17,19-20,22H,7,10-11H2,1-6H3/b9-8-/t13-,14+,15+,17+,19-,20-,21-/m0/s1

inchikey

  • BINVZINZKJFBTL-QQJLSPJJSA-N

mass

  • 318.501

monoisotopicmass

  • 318.25588

smiles

  • [C@]1([C@H](C(=C[C@@]2([C@@]1([C@@H](C[C@@H](C2)C)C)[H])[H])C)[C@@H](CC)C)(C(=O)/C=C/O)C

subset

  • 2_STAR

synonym EXACT

  • dehydroprobetaenone I

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:145061

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