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Chemistry, part 2

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 > lipid > fatty acid derivative > icosanoid > prostanoid > dihomoavicholic acid

Preferred term

dihomoavicholic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C26H44O5

inchi

  • InChI=1S/C26H44O5/c1-15(6-4-5-7-22(30)31)24-21(29)14-19-23-18(9-11-26(19,24)3)25(2)10-8-17(27)12-16(25)13-20(23)28/h15-21,23-24,27-29H,4-14H2,1-3H3,(H,30,31)/t15-,16+,17-,18+,19+,20-,21-,23-,24+,25+,26+/m1/s1

inchikey

  • UVPXQNAFSCJRMX-GQILHKQBSA-N

mass

  • 436.633

monoisotopicmass

  • 436.31887

smiles

  • O[C@H]1[C@]2([C@]3([C@@]([C@]([C@H](O)C3)([C@@H](CCCCC(O)=O)C)[H])(CC[C@@]2([C@@]4([C@](C1)(C[C@H](O)CC4)[H])C)[H])C)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • (6R)-6-[(3R,5S,7R,8R,9S,10S,13S,14S,16R,17R)-3,7,16-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:193467

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