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Concept information

Preferred term

cochliodone g  

Type

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

Broader concept

charge

  • 0

formula

  • C35H38O13

inchi

  • InChI=1S/C35H38O13/c1-18(37)9-7-11-22-13-24-26(15-44-22)30(40)34(5,47-20(3)38)32(42)28(24)29-25-14-23(12-8-10-19(2)46-17-36)45-16-27(25)31(41)35(6,33(29)43)48-21(4)39/h13-19,37H,7-12H2,1-6H3/t18?,19?,34-,35+/m0/s1

inchikey

  • DFPZJXAFNKWLNU-HMHDNZLNSA-N

mass

  • 666.676

monoisotopicmass

  • 666.23124

smiles

  • O=C1C(C2=C3C(C(=O)[C@@](C2=O)(OC(=O)C)C)=COC(=C3)CCCC(O)C)=C4C(=COC(=C4)CCCC(OC=O)C)C([C@]1(OC(=O)C)C)=O

subset

  • 2_STAR

synonym EXACT

  • [(7R)-5-[(7S)-7-acetyloxy-3-(4-ormyloxypentyl)-7-methyl-6,8-dioxoisochromen-5-yl]-3-(4-hydroxypentyl)-7-methyl-6,8-dioxoisochromen-7-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199623

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