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Concept information

Preferred term

آلدوسترون همی استال 18 بتا گلوکورونید (1)  

Type

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

charge

  • -1

formula

  • C27H35O11

inchi

  • InChI=1S/C27H36O11/c1-26-7-6-12(29)8-11(26)2-3-13-14-4-5-15(16(30)10-28)27(14)9-17(18(13)26)36-25(27)38-24-21(33)19(31)20(32)22(37-24)23(34)35/h8,13-15,17-22,24-25,28,31-33H,2-7,9-10H2,1H3,(H,34,35)/p-1/t13-,14-,15+,17-,18+,19-,20-,21+,22-,24-,25?,26-,27+/m0/s1

inchikey

  • OMRIQCUHVVBJKI-QAUMJDADSA-M

mass

  • 535.567

monoisotopicmass

  • 535.21849

smiles

  • O1[C@@H]2[C@]3([C@]([C@]4([C@](C2)([C@H](CC4)C(=O)CO)C1O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C([O-])=O)[H])(CCC=6[C@@]3(CCC(=O)C6)C)[H])[H]

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:193596

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