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Concept information

Preferred term

Dehydroarmillylorsellinate  

Type

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

charge

  • 0

formula

  • C23H28O6

inchi

  • InChI=1S/C23H28O6/c1-11-5-12(25)6-16(26)18(11)21(28)29-17-9-23(4)15-8-22(2,3)7-13(15)20(27)14(10-24)19(17)23/h5-6,10,13,15,17,20,25-27H,7-9H2,1-4H3/t13-,15+,17-,20+,23-/m1/s1

inchikey

  • ZXLVDZRNPKMJND-NJORCMFTSA-N

mass

  • 400.471

monoisotopicmass

  • 400.18859

smiles

  • O=C(O[C@H]1C2=C(C=O)[C@@H](O)[C@@H]3CC(C[C@@H]3[C@@]2(C)C1)(C)C)C4=C(O)C=C(O)C=C4C

subset

  • 2_STAR

synonym EXACT

  • [(2R,4S,4aR,7aS,7bR)-3-ormyl-4-hydroxy-6,6,7b-trimethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta[e]inden-2-yl] 2,4-dihydroxy-6-methylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209977

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