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Concept information

organooxygen compound > ester > lactone > gamma-lactone > (7's)-parabenzlactone
organooxygen compound > oxacycle > lactone > gamma-lactone > (7's)-parabenzlactone
organooxygen compound > oxacycle > benzodioxoles > (7's)-parabenzlactone

Preferred term

(7's)-parabenzlactone  

Type

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

charge

  • 0

formula

  • C20H18O7

inchi

  • InChI=1S/C20H18O7/c21-19(12-2-4-16-18(7-12)27-10-25-16)14-8-23-20(22)13(14)5-11-1-3-15-17(6-11)26-9-24-15/h1-4,6-7,13-14,19,21H,5,8-10H2/t13-,14+,19-/m1/s1

inchikey

  • NHMODCAASJDQKF-BIENJYKASA-N

mass

  • 370.35270

monoisotopicmass

  • 370.10525

smiles

  • O[C@@H]([C@H]1COC(=O)[C@@H]1Cc1ccc2OCOc2c1)c1ccc2OCOc2c1

subset

  • 3_STAR

synonym EXACT

  • (3R,4R)-4-[(S)-(2H-1,3-benzodioxol-5-yl)(hydroxy)methyl]-3-[(2H-1,3-benzodioxol-5-yl)methyl]oxolan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70489

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