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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > benzofurans > 2-benzofurans > penicacid a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > penicacid a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > penicacid a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > penicacid a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > penicacid a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > penicacid a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > penicacid a

Preferred term

penicacid a  

Type

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

Broader concept

charge

  • 0

formula

  • C18H22O7

inchi

  • InChI=1S/C18H22O7/c1-9(13(19)7-14(20)21)5-6-11-16(23-3)10(2)12-8-25-18(22)15(12)17(11)24-4/h5,13,19H,6-8H2,1-4H3,(H,20,21)/t13-/m0/s1

inchikey

  • FLHIJSDWAVXPEH-ZDUSSCGKSA-N

mass

  • 350.367

monoisotopicmass

  • 350.13655

smiles

  • O=C1OCC=2C1=C(OC)C(=C(OC)C2C)CC=C([C@@H](O)CC(=O)O)C

subset

  • 2_STAR

synonym EXACT

  • (3S)-6-(4,6-dimethoxy-7-methyl-3-oxo-1H-2-benzouran-5-yl)-3-hydroxy-4-methylhex-4-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214924

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