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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > azaphilone > phomopsiketone b
... > 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 > azaphilone > phomopsiketone b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > azaphilone > phomopsiketone b

Preferred term

phomopsiketone b  

Type

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

Broader concept

charge

  • 0

formula

  • C12H18O5

inchi

  • InChI=1S/C12H18O5/c1-2-3-9-12(16)10-6(5-17-9)7(13)4-8(14)11(10)15/h8-9,11-12,14-16H,2-5H2,1H3/t8-,9+,11-,12+/m0/s1

inchikey

  • PQSAQAWQBGVJOF-BSJXLVFVSA-N

mass

  • 242.271

monoisotopicmass

  • 242.11542

smiles

  • O=C1C2=C([C@@H](O)[C@H](C1)O)[C@H](O)[C@@H](CCC)OC2

subset

  • 2_STAR

synonym EXACT

  • (3R,4S,5R,6S)-4,5,6-trihydroxy-3-propyl-1,3,4,5,6,7-hexahydroisochromen-8-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210875

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