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

Preferred term

nigakilactone h  

Type

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

Broader concept

charge

  • 0

formula

  • C22H32O8

inchi

  • InChI=1S/C22H32O8/c1-10-7-12(28-5)17(25)19(2)11(10)8-13-20(3)16(19)15(24)18(29-6)21(4,26)22(20,27)9-14(23)30-13/h7,10-11,13,15-16,18,24,26-27H,8-9H2,1-6H3/t10-,11+,13-,15+,16-,18-,19+,20-,21-,22+/m1/s1

inchikey

  • WTMHOKZZJFYIGE-FCESQLEQSA-N

mass

  • 424.48470

monoisotopicmass

  • 424.20972

smiles

  • CO[C@@H]1[C@@H](O)[C@@H]2[C@]3(C)[C@@H](C[C@H]4OC(=O)C[C@@](O)([C@]1(C)O)[C@@]24C)[C@H](C)C=C(OC)C3=O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:80874

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