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

Preferred term

sestermobaraene a  

Type

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

Broader concept

charge

  • 0

formula

  • C25H40

inchi

  • InChI=1S/C25H40/c1-16(2)17-7-10-22(3)13-14-23(4)11-8-18-19-9-12-24(18,5)21(15-20(17)22)25(19,23)6/h15-20H,7-14H2,1-6H3/t17-,18+,19+,20-,22+,23?,24-,25-/m0/s1

inchikey

  • JLUYQELLOPAXIJ-KPGSVVGFSA-N

mass

  • 340.595

monoisotopicmass

  • 340.31300

smiles

  • C12=C[C@@H]3[C@@](CCC4([C@]1([C@@H]5CC[C@]2([C@@H]5CC4)C)C)C)(CC[C@H]3C(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,4R,5S,8R,14R,15S,18R)-1,8,11,15-tetramethyl-5-propan-2-ylpentacyclo[9.7.0.02,15.04,8.014,18]octadec-2-ene

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211612

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