skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

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 > 12beta-hydroxycyclooctatin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > 12beta-hydroxycyclooctatin

Preferred term

12beta-hydroxycyclooctatin  

Type

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

Broader concept

charge

  • 0

formula

  • C20H34O4

inchi

  • InChI=1S/C20H34O4/c1-11(2)13-8-17(23)19(3)9-14-12(10-21)7-16(22)18(14)20(4,24)6-5-15(13)19/h5,11-14,16-18,21-24H,6-10H2,1-4H3/t12-,13+,14+,16+,17+,18-,19+,20-/m0/s1

inchikey

  • KRGUNUMKPQQOQA-OKQFKRJUSA-N

mass

  • 338.488

monoisotopicmass

  • 338.24571

smiles

  • O[C@@]1([C@H]2[C@@H]([C@H](CO)C[C@H]2O)C[C@]3([C@H](O)C[C@@H](C3=CC1)C(C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,3R,4R,6R,10S,11S,12R,14R)-14-(hydroxymethyl)-3,10-dimethyl-6-propan-2-yltricyclo[9.3.0.03,7]tetradec-7-ene-4,10,12-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206897

Download this concept:

RDF/XML TURTLE JSON-LD