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Concept information

Preferred term

اسید لوناتوئیک E  

Type

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

Broader concept

charge

  • 0

formula

  • C21H28O7

inchi

  • InChI=1S/C21H28O7/c1-5-12(2)8-13(3)20(25)28-19-16-11-27-15(6-7-18(23)24)9-14(16)10-17(22)21(19,4)26/h6-7,9-10,12-13,16,19,26H,5,8,11H2,1-4H3,(H,23,24)/t12-,13-,16-,19-,21+/m0/s1

inchikey

  • BABRVDYMEWNGHT-KWHVVNMYSA-N

mass

  • 392.448

monoisotopicmass

  • 392.18350

smiles

  • O=C1C=C2C=C(OC[C@@H]2[C@@H]([C@@]1(O)C)OC(=O)[C@H](C[C@H](CC)C)C)C=CC(=O)O

subset

  • 2_STAR

synonym EXACT

  • 3-[(7S,8S,8aR)-8-[(2S,4S)-2,4-dimethylhexanoyl]oxy-7-hydroxy-7-methyl-6-oxo-8,8a-dihydro-1H-isochromen-3-yl]prop-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214778

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