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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > delta-lactone > isocoumarins > (9r∗)-8-methyl-9,11-dichlorodiaporthin
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > delta-lactone > isocoumarins > (9r∗)-8-methyl-9,11-dichlorodiaporthin
... > organooxygen compound > ester > lactone > delta-lactone > isocoumarins > (9r∗)-8-methyl-9,11-dichlorodiaporthin
... > organooxygen compound > oxacycle > lactone > delta-lactone > isocoumarins > (9r∗)-8-methyl-9,11-dichlorodiaporthin
... > organooxygen compound > oxacycle > benzopyran > 2-benzopyran > isochromenes > isocoumarins > (9r∗)-8-methyl-9,11-dichlorodiaporthin

Preferred term

(9r∗)-8-methyl-9,11-dichlorodiaporthin  

Type

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

Broader concept

charge

  • 0

formula

  • C14H14Cl2O5

inchi

  • InChI=1S/C14H14Cl2O5/c1-19-8-3-7-4-11(13(16)9(17)6-15)21-14(18)12(7)10(5-8)20-2/h3-5,9,13,17H,6H2,1-2H3/t9-,13+/m0/s1

inchikey

  • PXZNVKGVHPZSHR-TVQRCGJNSA-N

mass

  • 333.160

monoisotopicmass

  • 332.02183

smiles

  • Cl[C@@H](C=1OC(=O)C=2C(OC)=CC(=CC2C1)OC)[C@@H](O)CCl

subset

  • 2_STAR

synonym EXACT

  • 3-[(1R,2S)-1,3-dichloro-2-hydroxypropyl]-6,8-dimethoxyisochromen-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209762

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