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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 > lipid > steroid > 5alpha-cholestane-3beta,7alpha,12alpha,25,26-pentol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > 5alpha-cholestane-3beta,7alpha,12alpha,25,26-pentol
... > 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 > 5alpha-cholestane-3beta,7alpha,12alpha,25,26-pentol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > 5alpha-cholestane-3beta,7alpha,12alpha,25,26-pentol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > 5alpha-cholestane-3beta,7alpha,12alpha,25,26-pentol

Preferred term

5alpha-cholestane-3beta,7alpha,12alpha,25,26-pentol  

Type

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

Broader concept

charge

  • 0

formula

  • C27H48O5

inchi

  • InChI=1S/C27H48O5/c1-16(6-5-10-25(2,32)15-28)19-7-8-20-24-21(14-23(31)27(19,20)4)26(3)11-9-18(29)12-17(26)13-22(24)30/h16-24,28-32H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21+,22-,23+,24+,25?,26+,27-/m1/s1

inchikey

  • XZDHXPDYLPEFQI-CGNNBXCQSA-N

mass

  • 452.676

monoisotopicmass

  • 452.35017

smiles

  • O[C@@H]1[C@]2([C@]([C@]3([C@@]([C@@]4([C@@](C[C@H]3O)(C[C@@H](O)CC4)[H])C)(C1)[H])[H])(CC[C@@]2([C@@H](CCCC(O)(CO)C)C)[H])[H])C

subset

  • 2_STAR

synonym EXACT

  • (3S,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-6,7-dihydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190382

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