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Chemistry, part 2

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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 > lipid > steroid > cholestanoid > (25r)-24r,26r-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > (25r)-24r,26r-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > (25r)-24r,26r-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > (25r)-24r,26r-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > cholestanoid > (25r)-24r,26r-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol

Preferred term

(25r)-24r,26r-dimethyl-26,27-cyclo-cholest-5-en-3beta-ol  

Type

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

Broader concept

charge

  • 0

formula

  • C29H48O

inchi

  • InChI=1S/C29H48O/c1-18(24-16-20(24)3)6-7-19(2)25-10-11-26-23-9-8-21-17-22(30)12-14-28(21,4)27(23)13-15-29(25,26)5/h8,18-20,22-27,30H,6-7,9-17H2,1-5H3/t18-,19-,20-,22+,23+,24+,25-,26+,27+,28+,29-/m1/s1

inchikey

  • AOOVLQXWRHMRMX-BFPAFGTMSA-N

mass

  • 412.702

monoisotopicmass

  • 412.37052

smiles

  • O[C@@H]1CC=2[C@@]([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@@H](CC[C@H]([C@]5([C@@H](C5)C)[H])C)C)[H])(CC3)C)[H])(CC2)[H])[H])(CC1)C

subset

  • 2_STAR

synonym EXACT

  • (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R,5R)-5-[(1R,2R)-2-methylcyclopropyl]hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173046

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