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Concept information

organooxygen compound > ester > lactone > terpene lactone > pestalotiolactone a

Preferred term

pestalotiolactone a  

Type

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

Broader concept

charge

  • 0

formula

  • C10H16O3

inchi

  • InChI=1S/C10H16O3/c1-5-8-6(2)10(3,12)4-7(8)13-9(5)11/h5-8,12H,4H2,1-3H3/t5-,6-,7-,8+,10+/m1/s1

inchikey

  • ZNLOKJLITCSYPQ-BGJNVIQHSA-N

mass

  • 184.235

monoisotopicmass

  • 184.10994

smiles

  • O=C1O[C@@H]2C[C@@](O)(C)[C@@H]([C@@H]2[C@H]1C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,3aR,4R,5S,6aR)-5-hydroxy-3,4,5-trimethyl-3a,4,6,6a-tetrahydro-3H-cyclopenta[b]uran-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217388

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