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Concept information

Preferred term

(3s,6r)-9,10-seco-5(10),6,7-cholestatrien-3-ol  

Type

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

Broader concept

charge

  • 0

formula

  • C27H44O

inchi

  • InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h13,19,21,24-26,28H,6-11,14-18H2,1-5H3/t12-,21+,24-,25+,26-,27+/m0/s1

inchikey

  • YZGASHZUSKGPDO-MNHCFFFESA-N

mass

  • 384.648

monoisotopicmass

  • 384.33922

smiles

  • [C@](=C1CCC[C@]2([C@]1(CC[C@@]2([C@@](CCCC(C)C)(C)[H])[H])[H])C)=C(C=3C[C@H](CCC3C)O)[H]

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:172964

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