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Chemistry, part 2

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Concept information

organooxygen compound > oxacycle > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate
... > 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 > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate
... > 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 > organic heteromonocyclic compound > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > [(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate

Preferred term

[(1s,3r,4s,6s,7r,8s,8ar)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2r)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2s)-2-methylbutanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C24H36O6

inchi

  • InChI=1S/C24H36O6/c1-5-13(2)24(28)30-20-11-14(3)23(27)18-12-19(25)15(4)17(22(18)20)10-9-16-7-6-8-21(26)29-16/h6,8,12-17,19-20,22-23,25,27H,5,7,9-11H2,1-4H3/t13-,14+,15+,16-,17-,19+,20-,22+,23-/m0/s1

inchikey

  • SUFMCVCPZXZQLY-RZAPNLABSA-N

mass

  • 420.546

monoisotopicmass

  • 420.25119

smiles

  • O=C1O[C@@H](CC=C1)CC[C@@H]2[C@@H]3C(=C[C@H]([C@@H]2C)O)[C@@H](O)[C@H](C)C[C@@H]3OC(=O)[C@H](CC)C

subset

  • 2_STAR

synonym EXACT

  • [(1S,3R,4S,6S,7R,8S,8aR)-4,6-dihydroxy-3,7-dimethyl-8-[2-[(2R)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] (2S)-2-methylbutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227743

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