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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > benzofurans > 5′-hydroxypenisimplicibetain
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 5′-hydroxypenisimplicibetain
... > 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 > 5′-hydroxypenisimplicibetain
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > 5′-hydroxypenisimplicibetain
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 5′-hydroxypenisimplicibetain
... > 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 > 5′-hydroxypenisimplicibetain
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > 5′-hydroxypenisimplicibetain

Preferred term

5′-hydroxypenisimplicibetain  

Type

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

Broader concept

charge

  • 0

formula

  • C16H14O7

inchi

  • InChI=1S/C16H14O7/c1-7-13(17)14(18)10(6-22-7)15-12-9(16(19)23-15)4-8(20-2)5-11(12)21-3/h4-6,15,17H,1-3H3/t15-/m0/s1

inchikey

  • LAHRZGCPSGPXQO-HNNXBMFYSA-N

mass

  • 318.281

monoisotopicmass

  • 318.07395

smiles

  • O=C1C(O)=C(OC=C1[C@@H]2OC(=O)C=3C2=C(OC)C=C(OC)C3)C

subset

  • 2_STAR

synonym EXACT

  • (3R)-3-(5-hydroxy-6-methyl-4-oxopyran-3-yl)-4,6-dimethoxy-3H-2-benzouran-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227851

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