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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 > histidinolithocholic acid

Preferred term

histidinolithocholic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C30H47N3O4

inchi

  • InChI=1S/C30H47N3O4/c1-18(4-9-27(35)33-26(28(36)37)15-20-16-31-17-32-20)23-7-8-24-22-6-5-19-14-21(34)10-12-29(19,2)25(22)11-13-30(23,24)3/h16-19,21-26,34H,4-15H2,1-3H3,(H,31,32)(H,33,35)(H,36,37)/t18-,19-,21-,22+,23-,24+,25+,26+,29+,30-/m1/s1

inchikey

  • QRYCQXDRMGWBEF-SEGADCSLSA-N

mass

  • 513.723

monoisotopicmass

  • 513.35666

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]4CC[C@]23C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:232175

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