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Concept information

organooxygen compound > aspertetranone b

Preferred term

aspertetranone b  

Type

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

charge

  • 0

formula

  • C21H24O9

inchi

  • InChI=1S/C21H24O9/c1-8-6-10-12(15(24)29-8)14(23)13-9(2)20(27)7-11(22)18(3,4)16(25)21(20,28)17(26)19(13,5)30-10/h6,9,13,17,26-28H,7H2,1-5H3/t9-,13+,17+,19+,20-,21-/m1/s1

inchikey

  • JTVMNJUTRHAGJS-JEIGLBJOSA-N

mass

  • 420.414

monoisotopicmass

  • 420.14203

smiles

  • O=C1OC(=CC2=C1C(=O)[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-1,5,11,15,15-pentamethyl-2,6-dioxatetracyclo[8.8.0.03,8.012,17]octadeca-3(8),4-diene-7,9,14,16-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210932

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