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Concept information

organooxygen compound > ether > cyclic ether > epoxide > inumakilactone b

Preferred term

inumakilactone b  

Type

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

charge

  • 0

formula

  • C18H18O7

has_role

inchi

  • InChI=1S/C18H18O7/c1-4-7-18-6(5-8(19)22-7)16(2)11-9(14(18)25-18)24-15(21)17(11,3)12(20)10-13(16)23-10/h4-5,7,9-14,20H,1H2,2-3H3/t7-,9+,10-,11-,12+,13-,14-,16-,17-,18-/m1/s1

inchikey

  • VLRYBJQMQSJMHB-UNJPOVPCSA-N

mass

  • 346.33130

monoisotopicmass

  • 346.10525

smiles

  • [H][C@]12O[C@@]1([H])[C@]1(C)C3=CC(=O)O[C@H](C=C)[C@]33O[C@@H]3[C@@]3([H])OC(=O)[C@@](C)([C@H]2O)[C@@]13[H]

subset

  • 3_STAR

synonym EXACT

  • (1aR,1bS,3aR,3bR,4R,4aR,5aS,5bS,9R,9aR)-9-ethenyl-4-hydroxy-3a,5b-dimethyl-1a,1b,3a,3b,4,4a,5a,5b-octahydro-3H,7H-oxireno[5,6][2]benzofuro[7,1-fg]oxireno[i]isochromene-3,7-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68294

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