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... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
organooxygen compound > ester > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
organooxygen compound > oxacycle > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid

Preferred term

2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1h-2-benzofuran-4-yl)prop-2-enoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O5

inchi

  • InChI=1S/C15H20O5/c1-8(2)11-4-3-9-7-20-15(19)13(9)12(11)5-10(6-16)14(17)18/h5,8,11-12,16H,3-4,6-7H2,1-2H3,(H,17,18)

inchikey

  • YWASZTJGPFRWMW-UHFFFAOYSA-N

mass

  • 280.320

monoisotopicmass

  • 280.13107

smiles

  • O1CC=2CCC(C(C2C1=O)C=C(CO)C(O)=O)C(C)C

subset

  • 2_STAR

synonym EXACT

  • 2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1H-2-benzouran-4-yl)prop-2-enoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:182377

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