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Concept information

Preferred term

24-methylene-cholest-5-en-3beta,19-diol  

Type

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

Broader concept

charge

  • 0

formula

  • C28H46O2

inchi

  • InChI=1S/C28H46O2/c1-18(2)19(3)6-7-20(4)24-10-11-25-23-9-8-21-16-22(30)12-15-28(21,17-29)26(23)13-14-27(24,25)5/h8,18,20,22-26,29-30H,3,6-7,9-17H2,1-2,4-5H3/t20-,22+,23+,24-,25+,26+,27-,28-/m1/s1

inchikey

  • WOOKNJANWWBKHW-TURLQYGPSA-N

mass

  • 414.674

monoisotopicmass

  • 414.34978

smiles

  • OC[C@@]12[C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@@H](CCC(C(C)C)=C)C)[H])(CC3)C)[H])(CC=C1C[C@@H](O)CC2)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • (3S,8S,9S,10S,13R,14S,17R)-10-(hydroxymethyl)-13-methyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173013

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