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Concept information

Preferred term

monacolin j carboxylate  

Type

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

charge

  • -1

formula

  • C19H29O5

inchi

  • InChI=1S/C19H30O5/c1-11-7-13-4-3-12(2)16(19(13)17(22)8-11)6-5-14(20)9-15(21)10-18(23)24/h3-4,7,11-12,14-17,19-22H,5-6,8-10H2,1-2H3,(H,23,24)/p-1/t11-,12-,14+,15+,16-,17-,19-/m0/s1

inchikey

  • FJQFRDAWQRBFCG-IRUSZSJRSA-M

is_conjugate_base_of

mass

  • 337.43110

monoisotopicmass

  • 337.20205

smiles

  • C[C@@H]1C[C@H](O)[C@@H]2[C@@H](CC[C@@H](O)C[C@@H](O)CC([O-])=O)[C@@H](C)C=CC2=C1

subset

  • 3_STAR

synonym EXACT

  • (3R,5R)-3,5-dihydroxy-7-[(1S,2S,6R,8S,8aR)-8-hydroxy-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoate
  • monacolin J carboxylate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79035

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