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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > gamma-lactone > 6alpha-acetoxyisoinuviscolide
organooxygen compound > ester > lactone > gamma-lactone > 6alpha-acetoxyisoinuviscolide
organooxygen compound > oxacycle > lactone > gamma-lactone > 6alpha-acetoxyisoinuviscolide
organooxygen compound > ester > carboxylic ester > acetate ester > 6alpha-acetoxyisoinuviscolide
... > organooxygen compound > ester > lactone > terpene lactone > sesquiterpene lactone > 6alpha-acetoxyisoinuviscolide

Preferred term

6alpha-acetoxyisoinuviscolide  

Type

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

charge

  • 0

formula

  • C17H22O5

inchi

  • InChI=1S/C17H22O5/c1-8-7-12-13(9(2)16(19)22-12)15(21-10(3)18)14-11(8)5-6-17(14,4)20/h7,11-15,20H,2,5-6H2,1,3-4H3/t11-,12+,13-,14+,15+,17-/m1/s1

inchikey

  • PLSCGWSBZMOKAA-RURKYGKJSA-N

mass

  • 306.35360

monoisotopicmass

  • 306.14672

smiles

  • CC(=O)O[C@H]1[C@H]2[C@@H](OC(=O)C2=C)C=C(C)[C@H]2CC[C@@](C)(O)[C@H]12

subset

  • 3_STAR

synonym EXACT

  • (3aR,4S,4aS,5R,7aS,9aS)-5-hydroxy-5,8-dimethyl-3-methylidene-2-oxo-2,3,3a,4,4a,5,6,7,7a,9a-decahydroazuleno[6,5-b]furan-4-yl acetate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69341

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