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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 > sesquiterpenoid > (3s)-3-acetoxyeremophil-1(2),7(11),9(10)-trien-8-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > (3s)-3-acetoxyeremophil-1(2),7(11),9(10)-trien-8-one

Preferred term

(3s)-3-acetoxyeremophil-1(2),7(11),9(10)-trien-8-one  

Type

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

Broader concept

charge

  • 0

formula

  • C17H22O3

inchi

  • InChI=1S/C17H22O3/c1-10(2)14-9-17(5)11(3)16(20-12(4)18)7-6-13(17)8-15(14)19/h6-8,11,16H,9H2,1-5H3/t11-,16-,17+/m0/s1

inchikey

  • FJZBAGIMAUDSAO-MZPVMMEZSA-N

mass

  • 274.360

monoisotopicmass

  • 274.15689

smiles

  • O=C1C(=C(C)C)C[C@@]2([C@H]([C@@H](OC(=O)C)C=CC2=C1)C)C

subset

  • 2_STAR

synonym EXACT

  • [(1R,2S,8aR)-1,8a-dimethyl-6-oxo-7-propan-2-ylidene-2,8-dihydro-1H-naphthalen-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203992

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