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

Preferred term

phellilin a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O3

inchi

  • InChI=1S/C15H20O3/c1-9(6-14(17)18)10-7-11-12(8-10)15(2,3)5-4-13(11)16/h6,10H,4-5,7-8H2,1-3H3,(H,17,18)/t10-/m1/s1

inchikey

  • KWLZQMPOIJYXDR-SNVBAGLBSA-N

mass

  • 248.322

monoisotopicmass

  • 248.14124

smiles

  • O=C1C2=C(C(C)(C)CC1)C[C@@H](C2)C(=CC(=O)O)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(2S)-4,4-dimethyl-7-oxo-2,3,5,6-tetrahydro-1H-inden-2-yl]but-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208024

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