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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > 13-hydroxydihydromelleolide
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > 13-hydroxydihydromelleolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > 13-hydroxydihydromelleolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > 13-hydroxydihydromelleolide

Preferred term

13-hydroxydihydromelleolide  

Type

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

Broader concept

charge

  • 0

formula

  • C23H30O7

inchi

  • InChI=1S/C23H30O7/c1-12-5-14(25)6-15(26)18(12)19(27)30-17-9-21(4)16-8-20(2,3)11-22(16,28)7-13(10-24)23(17,21)29/h5-7,16-17,24-26,28-29H,8-11H2,1-4H3

inchikey

  • ABFOJGYAILKEJB-UHFFFAOYSA-N

mass

  • 418.486

monoisotopicmass

  • 418.19915

smiles

  • OC12C(C3C(O)(CC(C3)(C)C)C=C1CO)(CC2OC(=O)C=4C(=CC(O)=CC4O)C)C

subset

  • 2_STAR

synonym EXACT

  • [2a,4a-dihydroxy-3-(hydroxymethyl)-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2,4-dihydroxy-6-methylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175348

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