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Chemistry, part 3

Content language

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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 > carbonyl compound > neoglabrescin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > neoglabrescin a
... > 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 > carbonyl compound > neoglabrescin a
... > 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 > neoglabrescin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > neoglabrescin a

Preferred term

neoglabrescin a  

Type

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

Broader concept

charge

  • 0

formula

  • C23H30O9

inchi

  • InChI=1S/C23H30O9/c1-10-7-17-22(28)11(2)8-15(27)9-16(22)19-21(6,31-14(5)26)20(30-13(4)25)23(17,32-19)18(10)29-12(3)24/h7,11,16-20,28H,8-9H2,1-6H3/t11-,16-,17?,18+,19-,20-,21-,22-,23-/m1/s1

inchikey

  • RWOHROIADKDRDD-XESBKENASA-N

mass

  • 450.484

monoisotopicmass

  • 450.18898

smiles

  • O1[C@@]23C([C@]4(O)[C@@]([C@@]1([C@@](OC(=O)C)([C@H]2OC(=O)C)C)[H])(CC(=O)C[C@H]4C)[H])C=C([C@@H]3OC(=O)C)C

subset

  • 2_STAR

synonym EXACT

  • [(1R,2S,6R,7R,11R,12R,13R,14R)-13,14-diacetyloxy-6-hydroxy-3,7,13-trimethyl-9-oxo-15-oxatetracyclo[10.2.1.01,5.06,11]pentadec-3-en-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185367

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