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Concept information

Preferred term

Eremofortin C  

Type

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

Broader concept

charge

  • 0

formula

  • C17H22O6

inchi

  • InChI=1S/C17H22O6/c1-8-12(21-9(2)19)14-13(22-14)10-5-11(20)17(6-15(8,10)3)16(4,7-18)23-17/h5,8,12-14,18H,6-7H2,1-4H3/t8-,12+,13-,14+,15+,16+,17-/m0/s1

inchikey

  • AVFUXCSVVLQAGL-VIEAGMIOSA-N

mass

  • 322.357

monoisotopicmass

  • 322.14164

smiles

  • O=C1C=C2[C@]([C@H]([C@@H](OC(=O)C)[C@@H]3[C@H]2O3)C)(C)C[C@]14O[C@@]4(CO)C

subset

  • 2_STAR

synonym EXACT

  • [(1aR,2R,3R,3'R,3aR,5R,7bS)-3'-(hydroxymethyl)-3,3',3a-trimethyl-6-oxospiro[2,3,4,7b-tetrahydro-1aH-naphtho[1,2-b]oxirene-5,2'-oxirane]-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200938

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