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Chemistry, part 2

Content language

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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 > coniellin h
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > coniellin h

Preferred term

coniellin h  

Type

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

Broader concept

charge

  • 0

formula

  • C23H28O7

inchi

  • InChI=1S/C23H28O7/c1-5-6-7-8-12-16-17(25)15(21(27)29-4)18-22(3,28)19(26)13(10-24)14-9-11(2)30-20(12)23(14,16)18/h9-10,12,15-16,18,20,28H,5-8H2,1-4H3/t12-,15+,16+,18+,20+,22+,23-/m0/s1

inchikey

  • XAHOFHHJQNUHFY-KXIWCRNYSA-N

mass

  • 416.470

monoisotopicmass

  • 416.18350

smiles

  • O=C1C(=C2C=C(O[C@H]3[C@]24[C@@H](C([C@H]([C@@H]4[C@]1(O)C)C(=O)OC)=O)[C@@H]3CCCCC)C)C=O

subset

  • 2_STAR

synonym EXACT

  • methyl (1S,3S,4S,5R,12R,13S,14R)-7-ormyl-5-hydroxy-5,10-dimethyl-2,6-dioxo-13-pentyl-11-oxatetracyclo[6.5.1.04,14.012,14]tetradeca-7,9-diene-3-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211205

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