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Chemistry, part 2

Content language

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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > dicarboxylic acid > fusaspirol b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > dicarboxylic acid > fusaspirol b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > dicarboxylic acid > fusaspirol b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > dicarboxylic acid > fusaspirol b

Preferred term

fusaspirol b  

Type

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

Broader concept

charge

  • 0

formula

  • C17H20O6

inchi

  • InChI=1S/C17H20O6/c1-4-5-6-7-12-8-9-13(23-11(3)18)15(20)17(12)14(19)10(2)22-16(17)21/h4-9,12-15,19-20H,2H2,1,3H3/b5-4+,7-6+/t12-,13+,14+,15+,17+/m1/s1

inchikey

  • QDKWUNFAPAGADH-FWBHNOMLSA-N

mass

  • 320.341

monoisotopicmass

  • 320.12599

smiles

  • O=C1OC(=C)[C@@H]([C@]12[C@@H](C=C[C@@H]([C@@H]2O)OC(=O)C)/C=C/C=C/C)O

subset

  • 2_STAR

synonym EXACT

  • [(4R,5R,6R,7S,10R)-4,6-dihydroxy-3-methylidene-1-oxo-10-[(1E,3E)-penta-1,3-dienyl]-2-oxaspiro[4.5]dec-8-en-7-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226580

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