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Concept information

... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclic terpene ketone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
... > organooxygen compound > carbonyl compound > ketone > terpene ketone > cyclic terpene ketone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
organooxygen compound > oxacycle > azulenofuran > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > sesquiterpene lactone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > sesquiterpene lactone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
... > organooxygen compound > ester > lactone > terpene lactone > sesquiterpene lactone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate
... > organooxygen compound > oxacycle > lactone > terpene lactone > sesquiterpene lactone > 11beta,13-dihydro-8-deoxylactucin 15-oxalate

Preferred term

11beta,13-dihydro-8-deoxylactucin 15-oxalate  

Type

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

charge

  • 0

formula

  • C17H18O7

has_functional_parent

inchi

  • InChI=1S/C17H18O7/c1-7-3-4-10-8(2)16(21)24-14(10)13-9(5-11(18)12(7)13)6-23-17(22)15(19)20/h5,8,10,13-14H,3-4,6H2,1-2H3,(H,19,20)/t8-,10-,13-,14-/m0/s1

inchikey

  • DLXJJCZRGOSZAZ-LMVZTGKYSA-N

mass

  • 334.321

monoisotopicmass

  • 334.10525

smiles

  • O(CC1=CC(=O)C2=C(C)CC[C@]3([C@H](C)C(=O)O[C@@]3([C@@]12[H])[H])[H])C(C(=O)O)=O

subset

  • 3_STAR

synonym EXACT

  • {[(3S,3aS,9aS,9bS)-3,6-dimethyl-2,7-dioxo-2,3,3a,4,5,7,9a,9b-octahydroazuleno[4,5-b]furan-9-yl]methoxy}(oxo)acetic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:90278

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