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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 > tertiary alcohol > decumbenone d
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > decumbenone d

Preferred term

decumbenone d  

Type

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

Broader concept

charge

  • 0

formula

  • C18H28O4

inchi

  • InChI=1S/C18H28O4/c1-5-22-9-7-15(20)18(4)16-13(6-8-17(18,3)21)10-12(2)11-14(16)19/h6,8,10,12,14,16,19,21H,5,7,9,11H2,1-4H3/t12-,14+,16-,17-,18-/m1/s1

inchikey

  • PWHWKCZDBLCZDK-PYHPYESLSA-N

mass

  • 308.418

monoisotopicmass

  • 308.19876

smiles

  • O=C([C@]1([C@](O)(C=CC=2[C@@H]1[C@@H](O)C[C@@H](C2)C)C)C)CCOCC

subset

  • 2_STAR

synonym EXACT

  • 1-[(1R,2R,6S,8S,8aS)-2,8-dihydroxy-1,2,6-trimethyl-6,7,8,8a-tetrahydronaphthalen-1-yl]-3-ethoxypropan-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212940

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