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Concept information

Preferred term

l-alanocholate  

Type

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

charge

  • -1

formula

  • C27H44NO6

inchi

  • InChI=1S/C27H45NO6/c1-14(5-8-23(32)28-15(2)25(33)34)18-6-7-19-24-20(13-22(31)27(18,19)4)26(3)10-9-17(29)11-16(26)12-21(24)30/h14-22,24,29-31H,5-13H2,1-4H3,(H,28,32)(H,33,34)/p-1/t14-,15+,16+,17-,18-,19+,20+,21-,22+,24+,26+,27-/m1/s1

inchikey

  • AZWGEBXBDOIOHW-OKVQJXITSA-M

mass

  • 478.651

monoisotopicmass

  • 478.31741

smiles

  • C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])O)[H])(CC[C@]4([H])[C@@H](CCC(N[C@H](C(=O)[O-])C)=O)C)[H])C)O)[H])C

subset

  • 2_STAR

synonym EXACT

  • L-alanocholate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229710

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