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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 > organic hydroxy compound > alcohol > secondary alcohol > pestalustaine a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > pestalustaine a

Preferred term

pestalustaine a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H24O3

inchi

  • InChI=1S/C15H24O3/c1-13-4-3-12(18)15(9-17)10(5-13)6-14(2,8-16)11(15)7-13/h3-4,10-12,16-18H,5-9H2,1-2H3/t10-,11+,12-,13+,14-,15-/m1/s1

inchikey

  • DIUIQBFYLNYRSD-ARSDKDGVSA-N

mass

  • 252.354

monoisotopicmass

  • 252.17254

smiles

  • O[C@@H]1C=C[C@]2(C)C[C@@H]3[C@]1([C@H](C2)C[C@@]3(CO)C)CO

subset

  • 2_STAR

synonym EXACT

  • (1R,2R,3R,6S,8S,9S)-2,9-bis(hydroxymethyl)-6,9-dimethyltricyclo[4.4.1.02,8]undec-4-en-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217875

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