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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > monoterpenoid > iridoid monoterpenoid > epicocconigrone b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > iridoid monoterpenoid > epicocconigrone b

Preferred term

epicocconigrone b  

Type

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

Broader concept

charge

  • 0

formula

  • C17H18O6

inchi

  • InChI=1S/C17H18O6/c1-6-8(3)16(4)5-9-10(15(22)17(16,23)14(6)21)7(2)11(18)13(20)12(9)19/h18-20,23H,5H2,1-4H3/t16-,17-/m0/s1

inchikey

  • YKRJBZOAJFAGBE-IRXDYDNUSA-N

mass

  • 318.325

monoisotopicmass

  • 318.11034

smiles

  • O=C1C2=C(C(O)=C(O)C(=C2C)O)C[C@@]3([C@]1(O)C(=O)C(C)=C3C)C

subset

  • 2_STAR

synonym EXACT

  • (3aS,9aS)-5,6,7,9a-tetrahydroxy-2,3,3a,8-tetramethyl-4H-cyclopenta[b]naphthalene-1,9-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217921

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