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

Concept information

Preferred term

(25R) دلتا(4) دافاکرونات  

Type

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

charge

  • -1

formula

  • C27H41O3

inchi

  • InChI=1S/C27H42O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h16-18,21-24H,5-15H2,1-4H3,(H,29,30)/p-1/t17-,18-,21+,22-,23+,24+,26+,27-/m1/s1

inchikey

  • PSXQJZDFWDKBIP-MNVVPKPGSA-M

mass

  • 413.61260

monoisotopicmass

  • 413.30612

smiles

  • [H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC[C@@H](C)C([O-])=O

subset

  • 3_STAR

synonym EXACT

  • (5alpha,25R)-3-oxocholest-4-en-26-oate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:71570

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