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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > pyrans > pyranone > malbranpyrrole d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > malbranpyrrole d
... > 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 > pyrans > pyranone > malbranpyrrole d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > pyrans > pyranone > malbranpyrrole d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > malbranpyrrole d
... > 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 heteromonocyclic compound > pyrans > pyranone > malbranpyrrole d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyrans > pyranone > malbranpyrrole d

Preferred term

malbranpyrrole d  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22ClNO3

inchi

  • InChI=1S/C20H22ClNO3/c1-11(10-15-14(21)8-9-22-15)6-7-16-12(2)18-17(19(23)25-16)20(4,5)13(3)24-18/h6-10,13,22H,1-5H3/b7-6+,11-10+/t13-/m0/s1

inchikey

  • IMYZEZLKASQAKN-XAXKVJQESA-N

mass

  • 359.850

monoisotopicmass

  • 359.12882

smiles

  • ClC1=C(NC=C1)/C=C(/C=C/C=2OC(=O)C=3C(C)(C)[C@@H](OC3C2C)C)/C

subset

  • 2_STAR

synonym EXACT

  • 6-[(1E,3E)-4-(3-chloro-1H-pyrrol-2-yl)-3-methylbuta-1,3-dienyl]-2,3,3,7-tetramethyl-2H-uro[3,2-c]pyran-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209038

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