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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 > sesquiterpenoid > isocurcumenol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > isocurcumenol

Preferred term

isocurcumenol  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O2

inchi

  • InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h11-12,16H,3,5-8H2,1-2,4H3/t11-,12-,14-,15+/m0/s1

inchikey

  • DEBDFZGNZTYPMF-NZBPQXDJSA-N

mass

  • 234.339

monoisotopicmass

  • 234.16198

smiles

  • O1[C@]23[C@@](CC[C@@H]2C)(C(C[C@]1(O)C(C3)=C(C)C)=C)[H]

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,5S,8R)-2-methyl-6-methylidene-9-propan-2-ylidene-11-oxatricyclo[6.2.1.01,5]undecan-8-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:196142

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