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Chemistry, part 1

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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > cyclodepsipeptide > janadolide
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > cyclodepsipeptide > janadolide
organooxygen compound > ester > lactone > cyclodepsipeptide > janadolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > janadolide
... > organooxygen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > janadolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > depsipeptide > cyclodepsipeptide > janadolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > janadolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > janadolide

Preferred term

janadolide  

Type

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

Broader concept

charge

  • 0

formula

  • C37H63N5O7

inchi

  • InChI=1S/C37H63N5O7/c1-22(2)19-28-36(48)49-29(37(8,9)10)20-24(5)15-13-16-25(6)34(46)42-18-14-17-27(42)32(44)39-31(23(3)4)33(45)38-21-30(43)40(11)26(7)35(47)41(28)12/h20,22-23,25-29,31H,13-19,21H2,1-12H3,(H,38,45)(H,39,44)/b24-20+/t25-,26+,27+,28+,29+,31+/m1/s1

inchikey

  • XXTPBUDGINBRRD-IQFPJXEBSA-N

mass

  • 689.939

monoisotopicmass

  • 689.47275

smiles

  • O=C1O[C@@H](C=C(CCC[C@H](C(=O)N2[C@H](C(=O)N[C@H](C(NCC(N([C@H](C(N([C@H]1CC(C)C)C)=O)C)C)=O)=O)C(C)C)CCC2)C)C)C(C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,7E,9S,12S,15S,21S,24S)-9-tert-butyl-3,7,13,15,16-pentamethyl-12-(2-methylpropyl)-21-propan-2-yl-10-oxa-1,13,16,19,22-pentazabicyclo[22.3.0]heptacos-7-ene-2,11,14,17,20,23-hexone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227865

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