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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > polyketide > (5s)-5-[(2r)-2-carboxylato-2-hydroxy-2-methylethyl]-2,4-dioxo-3-[(2e,4r,6r,8e,10e,12e)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-3-ide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > polyketide > (5s)-5-[(2r)-2-carboxylato-2-hydroxy-2-methylethyl]-2,4-dioxo-3-[(2e,4r,6r,8e,10e,12e)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-3-ide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > polyketide > (5s)-5-[(2r)-2-carboxylato-2-hydroxy-2-methylethyl]-2,4-dioxo-3-[(2e,4r,6r,8e,10e,12e)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-3-ide

Preferred term

(5s)-5-[(2r)-2-carboxylato-2-hydroxy-2-methylethyl]-2,4-dioxo-3-[(2e,4r,6r,8e,10e,12e)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-3-ide  

Type

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

Broader concept

charge

  • -2

formula

  • C25H33NO6

inchi

  • InChI=1S/C25H34NO6/c1-6-16(2)10-8-7-9-11-17(3)14-18(4)12-13-20(27)21-22(28)19(26-23(21)29)15-25(5,32)24(30)31/h6-10,12-13,17-19,32H,11,14-15H2,1-5H3,(H,26,29)(H,30,31)/q-1/p-1/b9-7+,10-8+,13-12+,16-6+/t17-,18+,19+,25-/m1/s1

inchikey

  • XWIZBMORQRLANJ-NPPXQRPRSA-M

mass

  • 443.541

monoisotopicmass

  • 443.23188

smiles

  • C([C@@H](C/C=C/C=C/C(/C)=C/C)C)[C@H](/C=C/C([C-]1C([C@@H](NC1=O)C[C@@](C(=O)[O-])(C)O)=O)=O)C

subset

  • 2_STAR

synonym RELATED

  • (2R)-3-[(2S)-3,5-dioxo-4-[(2E,4R,6R,8E,10E,12E)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-2-yl]-2-hydroxy-2-methylpropanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:167912

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