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Chemistry, part 2

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Concept information

organooxygen compound > ester > carboxylic ester > fatty acid ester > 7-demethoxylegonol-2-methylbutanoate
organooxygen compound > carbonyl compound > carboxylic ester > fatty acid ester > 7-demethoxylegonol-2-methylbutanoate
... > 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 ester > fatty acid ester > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty acid ester > 7-demethoxylegonol-2-methylbutanoate
organooxygen compound > oxacycle > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
... > 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 > oxacycle > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
... > 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 > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxoles > 7-demethoxylegonol-2-methylbutanoate
organooxygen compound > oxacycle > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate
... > 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 > oxacycle > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate
... > 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 > organic heteropolycyclic compound > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 1-benzofurans > 7-demethoxylegonol-2-methylbutanoate

Preferred term

7-demethoxylegonol-2-methylbutanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C23H24O5

has_functional_parent

has_parent_hydride

has_role

inchi

  • InChI=1S/C23H24O5/c1-3-15(2)23(24)25-10-4-5-16-6-8-19-18(11-16)13-21(28-19)17-7-9-20-22(12-17)27-14-26-20/h6-9,11-13,15H,3-5,10,14H2,1-2H3/t15-/m0/s1

inchikey

  • MBOVWBBJDJPNSN-HNNXBMFYSA-N

mass

  • 380.43370

monoisotopicmass

  • 380.16237

smiles

  • CC[C@H](C)C(=O)OCCCc1ccc2oc(cc2c1)-c1ccc2OCOc2c1

subset

  • 3_STAR

synonym EXACT

  • 3-[2-(1,3-benzodioxol-5-yl)-1-benzofuran-5-yl]propyl (2S)-2-methylbutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69551

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