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Concept information

Preferred term

چنودوکسی کولیک اسید 3 O بتا گلوکوزید D  

Type

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

charge

  • 0

formula

  • C30H50O9

inchi

  • InChI=1S/C30H50O9/c1-15(4-7-23(33)34)18-5-6-19-24-20(9-11-30(18,19)3)29(2)10-8-17(12-16(29)13-21(24)32)38-28-27(37)26(36)25(35)22(14-31)39-28/h15-22,24-28,31-32,35-37H,4-14H2,1-3H3,(H,33,34)/t15-,16+,17-,18-,19+,20+,21-,22-,24+,25-,26+,27-,28-,29+,30-/m1/s1

inchikey

  • QRLIJDGVRXVHQD-UVMPBBQUSA-N

mass

  • 554.721

monoisotopicmass

  • 554.34548

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 3alpha-(beta-D-glucopyranosyloxy)-7alpha-hydroxy-5beta-cholan-24-oic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229688

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