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Concept information

Preferred term

L هیستیدوکولات  

Type

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

charge

  • -1

formula

  • C30H46N3O6

inchi

  • InChI=1S/C30H47N3O6/c1-16(4-7-26(37)33-23(28(38)39)12-18-14-31-15-32-18)20-5-6-21-27-22(13-25(36)30(20,21)3)29(2)9-8-19(34)10-17(29)11-24(27)35/h14-17,19-25,27,34-36H,4-13H2,1-3H3,(H,31,32)(H,33,37)(H,38,39)/p-1/t16-,17+,19-,20-,21+,22+,23+,24-,25+,27+,29+,30-/m1/s1

inchikey

  • GOBIDZCUVCOUAI-YJZFKLOMSA-M

mass

  • 544.714

monoisotopicmass

  • 544.33921

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-])CC=5N=CNC5)=O)C)[H])C)O)[H])C

subset

  • 2_STAR

synonym EXACT

  • L-histidocholate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229712

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