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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > azaphilone > isochromophilone vii
... > 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 > azaphilone > isochromophilone vii
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > azaphilone > isochromophilone vii

Preferred term

isochromophilone vii  

Type

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

Broader concept

charge

  • 0

formula

  • C21H25ClO6

inchi

  • InChI=1S/C21H25ClO6/c1-6-12(2)9-13(3)7-8-15-10-16-17(22)18(24)20(5,28-14(4)23)19(25)21(16,26)11-27-15/h7-10,12,26H,6,11H2,1-5H3/b8-7+,13-9+

inchikey

  • AJQIMDBOBJADCM-NJHPPEEMSA-N

mass

  • 408.880

monoisotopicmass

  • 408.13397

smiles

  • ClC=1C(=O)C(OC(=O)C)(C(=O)C2(C1C=C(OC2)/C=C/C(=C/C(CC)C)/C)O)C

subset

  • 2_STAR

synonym EXACT

  • [5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-8a-hydroxy-7-methyl-6,8-dioxo-1H-isochromen-7-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209862

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