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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
organooxygen compound > ester > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
organooxygen compound > oxacycle > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > delta-lactone > (2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester

Preferred term

(2s)-2-methylbutanoic acid [(7s,8s,8ar)-8-[2-[(2r)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] ester  

Type

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

Broader concept

charge

  • 0

formula

  • C24H36O5

inchi

  • InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14?,15-,16-,18?,19+,20-,21?,23-/m0/s1

inchikey

  • PCZOHLXUXFIOCF-WUIYGHNESA-N

mass

  • 404.541

monoisotopicmass

  • 404.25627

smiles

  • CC[C@H](C)C(=O)OC1CC(C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3CC(CC(=O)O3)O)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:95197

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