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Concept information

organooxygen compound > oxacycle > benzofurans > 2-benzofurans > (3's)-(e)-7-hydroxy-5-methoxy-4-methyl-6-(2-(2-methyl-5-oxotetrahydrofuran-2-yl)vinyl)isobenzofuran-1(3h)-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > (3's)-(e)-7-hydroxy-5-methoxy-4-methyl-6-(2-(2-methyl-5-oxotetrahydrofuran-2-yl)vinyl)isobenzofuran-1(3h)-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 2-benzofurans > (3's)-(e)-7-hydroxy-5-methoxy-4-methyl-6-(2-(2-methyl-5-oxotetrahydrofuran-2-yl)vinyl)isobenzofuran-1(3h)-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > (3's)-(e)-7-hydroxy-5-methoxy-4-methyl-6-(2-(2-methyl-5-oxotetrahydrofuran-2-yl)vinyl)isobenzofuran-1(3h)-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 2-benzofurans > (3's)-(e)-7-hydroxy-5-methoxy-4-methyl-6-(2-(2-methyl-5-oxotetrahydrofuran-2-yl)vinyl)isobenzofuran-1(3h)-one

Preferred term

(3's)-(e)-7-hydroxy-5-methoxy-4-methyl-6-(2-(2-methyl-5-oxotetrahydrofuran-2-yl)vinyl)isobenzofuran-1(3h)-one  

Type

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

Broader concept

charge

  • 0

formula

  • C17H18O6

inchi

  • InChI=1S/C17H18O6/c1-9-11-8-22-16(20)13(11)14(19)10(15(9)21-3)4-6-17(2)7-5-12(18)23-17/h4,6,19H,5,7-8H2,1-3H3/b6-4+/t17-/m1/s1

inchikey

  • YRCZYVVTZJUYBJ-UKINESCASA-N

mass

  • 318.325

monoisotopicmass

  • 318.11034

smiles

  • O=C1OCC=2C1=C(O)C(=C(OC)C2C)/C=C/[C@]3(OC(=O)CC3)C

subset

  • 2_STAR

synonym EXACT

  • 7-hydroxy-5-methoxy-4-methyl-6-[(E)-2-[(2S)-2-methyl-5-oxooxolan-2-yl]ethenyl]-3H-2-benzouran-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212369

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