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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 > 11,12,13-trinor-1,3,5,8-eudesmanetetrol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > 11,12,13-trinor-1,3,5,8-eudesmanetetrol

Preferred term

11,12,13-trinor-1,3,5,8-eudesmanetetrol  

Type

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

Broader concept

charge

  • 0

formula

  • C12H22O4

inchi

  • InChI=1S/C12H22O4/c1-7-9(14)5-10(15)11(2)6-8(13)3-4-12(7,11)16/h7-10,13-16H,3-6H2,1-2H3/t7-,8-,9+,10-,11+,12-/m1/s1

inchikey

  • VPJHVQMOXPUFGS-XZPZHEHLSA-N

mass

  • 230.304

monoisotopicmass

  • 230.15181

smiles

  • O[C@@]12[C@]([C@H](O)C[C@@H]([C@H]1C)O)(C[C@H](O)CC2)C

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,4R,4aR,7R,8aS)-4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-1,3,4a,7-tetrol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211952

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