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Concept information

Preferred term

6 اپی اکسی اسپوریدینون  

Type

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

charge

  • 0

formula

  • C28H43NO6

inchi

  • InChI=1S/C28H43NO6/c1-7-16(2)12-17(3)13-19(5)26-18(4)8-9-22(35-26)24-25(32)21(15-29(6)27(24)33)28(34)11-10-20(30)14-23(28)31/h13,15-18,22-23,26,31-32,34H,7-12,14H2,1-6H3/b19-13+/t16?,17?,18-,22+,23-,26-,28+/m1/s1

inchikey

  • CYNJYGDSSURTLH-HYJFNEQJSA-N

mass

  • 489.653

monoisotopicmass

  • 489.30904

smiles

  • O=C1N(C=C([C@]2(O)[C@H](O)CC(=O)CC2)C(=C1[C@H]3O[C@@H](/C(=C/C(CC(CC)C)C)/C)[C@H](C)CC3)O)C

subset

  • 2_STAR

synonym EXACT

  • 5-[(1S,2R)-1,2-dihydroxy-4-oxocyclohexyl]-3-[(2S,5R,6R)-6-[(E)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-4-hydroxy-1-methylpyridin-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199684

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