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Chemistry, part 1

Content language

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Concept information

organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > neopentalenolactone d
organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > neopentalenolactone d
organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > neopentalenolactone d
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > neopentalenolactone d
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > neopentalenolactone d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > sesquiterpene lactone > neopentalenolactone d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > sesquiterpene lactone > neopentalenolactone d

Preferred term

neopentalenolactone d  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O4

has_role

inchi

  • InChI=1S/C15H20O4/c1-8-15-7-14(2,3)6-9(15)4-10(13(17)18)11(15)5-12(16)19-8/h4,8-9,11H,5-7H2,1-3H3,(H,17,18)/t8-,9+,11-,15+/m0/s1

inchikey

  • ZMLAXRVFMBEJIF-GCTGHDABSA-N

is_conjugate_acid_of

mass

  • 264.31690

monoisotopicmass

  • 264.13616

smiles

  • [H][C@@]12CC(C)(C)C[C@@]11[C@H](C)OC(=O)C[C@@]1([H])C(=C2)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • (1S,4aR,6aS,9aR)-1,8,8-trimethyl-3-oxo-4,4a,6a,7,8,9-hexahydro-3H-pentaleno[6a,1-c]pyran-5-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70866

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