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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > delta-lactone > isocoumarins > 8'-o-ethyl-beta-alectoronic acid
... > organooxygen compound > ester > lactone > delta-lactone > isocoumarins > 8'-o-ethyl-beta-alectoronic acid
... > organooxygen compound > oxacycle > lactone > delta-lactone > isocoumarins > 8'-o-ethyl-beta-alectoronic acid
... > organooxygen compound > oxacycle > benzopyran > 2-benzopyran > isochromenes > isocoumarins > 8'-o-ethyl-beta-alectoronic acid

Preferred term

8'-o-ethyl-beta-alectoronic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C30H36O9

inchi

  • InChI=1S/C30H36O9/c1-4-7-9-11-20-14-18-13-19(31)15-24(25(18)28(34)37-20)38-27-21-17-30(36-6-3,12-10-8-5-2)39-29(35)26(21)22(32)16-23(27)33/h13-16,31-33H,4-12,17H2,1-3H3/t30-/m0/s1

inchikey

  • MQPGRJXZJRCSJW-PMERELPUSA-N

mass

  • 540.609

monoisotopicmass

  • 540.23593

smiles

  • O=C1OC(=CC=2C1=C(OC3=C(O)C=C(O)C4=C3C[C@](OCC)(CCCCC)OC4=O)C=C(O)C2)CCCCC

subset

  • 2_STAR

synonym EXACT

  • 3-ethoxy-6,8-dihydroxy-5-(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy-3-pentyl-4H-isochromen-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199957

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