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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > monoterpenoid > iridoid monoterpenoid > 11-deacetylvaltrate 11-(3-hydroxy-3-methylbutanoate)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > iridoid monoterpenoid > 11-deacetylvaltrate 11-(3-hydroxy-3-methylbutanoate)

Preferred term

11-deacetylvaltrate 11-(3-hydroxy-3-methylbutanoate)  

Type

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

Broader concept

charge

  • 0

formula

  • C25H36O9

inchi

  • InChI=1S/C25H36O9/c1-14(2)7-19(26)33-18-9-17-16(11-30-21(28)10-24(5,6)29)12-31-23(22(17)25(18)13-32-25)34-20(27)8-15(3)4/h9,12,14-15,18,22-23,29H,7-8,10-11,13H2,1-6H3

inchikey

  • QHYRSOLVOPZTHU-UHFFFAOYSA-N

mass

  • 480.554

monoisotopicmass

  • 480.23593

smiles

  • O1C2(C3C(=CC2OC(=O)CC(C)C)C(=COC3OC(=O)CC(C)C)COC(=O)CC(O)(C)C)C1

subset

  • 2_STAR

synonym EXACT

  • [1,6-bis(3-methylbutanoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl 3-hydroxy-3-methylbutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175765

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