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Concept information

... > organooxygen compound > ester > lactone > delta-lactone > isocoumarins > 12-epicitreoisocoumarinol
... > organooxygen compound > oxacycle > lactone > delta-lactone > isocoumarins > 12-epicitreoisocoumarinol

Preferred term

12-epicitreoisocoumarinol  

Type

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

Broader concept

charge

  • 0

formula

  • C14H16O6

inchi

  • InChI=1S/C14H16O6/c1-7(15)2-9(16)5-11-4-8-3-10(17)6-12(18)13(8)14(19)20-11/h3-4,6-7,9,15-18H,2,5H2,1H3/t7-,9+/m0/s1

inchikey

  • CQXZVXNVRFIVCN-IONNQARKSA-N

mass

  • 280.276

monoisotopicmass

  • 280.09469

smiles

  • O=C1OC(=CC=2C1=C(O)C=C(O)C2)C[C@H](O)C[C@@H](O)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(2R,4S)-2,4-dihydroxypentyl]-6,8-dihydroxyisochromen-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218631

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