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Concept information

Preferred term

(3E) 3 [(1R,5R,6S) 5 هیدروکسی 7 اگزابیسیکلو[4.1.0]هپتان 2 یلیدین]پیروویک اسید  

Type

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

charge

  • 0

formula

  • C9H10O5

has_functional_parent

inchi

  • InChI=1S/C9H10O5/c10-5-2-1-4(7-8(5)14-7)3-6(11)9(12)13/h3,5,7-8,10H,1-2H2,(H,12,13)/b4-3+/t5-,7-,8+/m1/s1

inchikey

  • AWPQUULTGMQXTH-UXOMXHMNSA-N

mass

  • 198.17270

monoisotopicmass

  • 198.05282

smiles

  • O[C@@H]1CC/C(=C/C(=O)C(O)=O)[C@H]2O[C@@H]12

subset

  • 3_STAR

synonym EXACT

  • (3E)-3-[(1R,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-ylidene]-2-oxopropanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85358

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