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Concept information

Preferred term

rubiginone i  

Type

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

Broader concept

charge

  • 0

formula

  • C22H20O8

inchi

  • InChI=1S/C22H20O8/c1-9-16(24)17(25)15-12(18(9)29-10(2)23)7-8-21-20(27)14-11(5-4-6-13(14)28-3)19(26)22(15,21)30-21/h4-9,16,18,20,24,27H,1-3H3/t9-,16+,18-,20?,21?,22?/m1/s1

inchikey

  • NONBUEJWSJNYAK-GHCOXSAKSA-N

mass

  • 412.394

monoisotopicmass

  • 412.11582

smiles

  • O=C1C2=C(C(OC)=CC=C2)C(O)C34C1(O3)C=5C(=O)[C@@H](O)[C@@H](C)[C@H](C5C=C4)OC(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(4S,5R,6R)-4,11-dihydroxy-13-methoxy-5-methyl-3,18-dioxo-19-oxapentacyclo[8.8.1.01,10.02,7.012,17]nonadeca-2(7),8,12(17),13,15-pentaen-6-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215065

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