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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 > lupeol acetate

Preferred term

lupeol acetate  

Type

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

Broader concept

alt_id

  • CHEBI:6571

charge

  • 0

formula

  • C32H52O2

has_role

inchi

  • InChI=1S/C32H52O2/c1-20(2)22-12-15-29(6)18-19-31(8)23(27(22)29)10-11-25-30(7)16-14-26(34-21(3)33)28(4,5)24(30)13-17-32(25,31)9/h22-27H,1,10-19H2,2-9H3/t22-,23+,24-,25+,26-,27+,29+,30-,31+,32+/m0/s1

inchikey

  • ODSSDTBFHAYYMD-YOJQYFTNSA-N

mass

  • 468.75410

monoisotopicmass

  • 468.39673

smiles

  • [H][C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@@]1(C)CC[C@@H](C(C)=C)[C@]21[H]

subset

  • 2_STAR

synonym EXACT

  • Lupeol acetate

synonym RELATED

  • 3-Acetyllupeol
  • (3beta)-Lup-20(29)-en-3-yl acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69744

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