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Concept information

organooxygen compound > aspertetranone c

Preferred term

aspertetranone c  

Type

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

charge

  • 0

formula

  • C22H28O8

inchi

  • InChI=1S/C22H28O8/c1-9-11(3)29-16(24)12-7-13-10(2)21(27)8-14(23)19(4,5)17(25)22(21,28)18(26)20(13,6)30-15(9)12/h10,13,18,26-28H,7-8H2,1-6H3/t10-,13-,18+,20+,21-,22-/m1/s1

inchikey

  • HPOOTMLUWHHBQS-SWOHXVJISA-N

mass

  • 420.458

monoisotopicmass

  • 420.17842

smiles

  • O=C1OC(=C(C)C2=C1C[C@@H]3[C@H]([C@]4(O)CC(=O)C(C([C@]4([C@H]([C@]3(O2)C)O)O)=O)(C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,10R,11R,12R,17R,18R)-12,17,18-trihydroxy-1,4,5,11,15,15-hexamethyl-2,6-dioxatetracyclo[8.8.0.03,8.012,17]octadeca-3(8),4-diene-7,14,16-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209759

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