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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > histidinodeoxycholic acid

Preferred term

histidinodeoxycholic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C30H47N3O5

inchi

  • InChI=1S/C30H47N3O5/c1-17(4-9-27(36)33-25(28(37)38)13-19-15-31-16-32-19)22-7-8-23-21-6-5-18-12-20(34)10-11-29(18,2)24(21)14-26(35)30(22,23)3/h15-18,20-26,34-35H,4-14H2,1-3H3,(H,31,32)(H,33,36)(H,37,38)/t17-,18-,20-,21+,22-,23+,24+,25+,26+,29+,30-/m1/s1

inchikey

  • HSUNTEFOMSKZCT-UFYMIWRUSA-N

mass

  • 529.722

monoisotopicmass

  • 529.35157

smiles

  • C[C@H](CCC(=O)N[C@@H](CC1=CNC=N1)C(O)=O)[C@H]2CC[C@H]3[C@@H]4CC[C@@H]5C[C@H](O)CC[C@]5(C)[C@H]4C[C@H](O)[C@]23C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:232214

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