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Concept information

Preferred term

دئوکسی پنتالنیل گلوکورون  

Type

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

charge

  • 0

formula

  • C21H30O8

inchi

  • InChI=1S/C21H30O8/c1-9-4-5-12-11(6-10-7-20(2,3)8-21(9,10)12)18(27)29-19-15(24)13(22)14(23)16(28-19)17(25)26/h6,9-10,12-16,19,22-24H,4-5,7-8H2,1-3H3,(H,25,26)/t9-,10-,12+,13+,14+,15+,16+,19+,21-/m1/s1

inchikey

  • BFYOGFPGIVIQCC-UPUKJNKPSA-N

mass

  • 410.463

monoisotopicmass

  • 410.19407

smiles

  • O=C(O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@@H]([C@@H]1O)O)C2=C[C@@H]3CC(C)(C)C[C@@]43[C@H]2CC[C@H]4C

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-[(1R,2R,5R,8S)-2,10,10-trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carbonyl]oxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223081

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