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Concept information

Preferred term

Orsellinylmontagnetol D  

Type

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

charge

  • 0

formula

  • C28H28O13

inchi

  • InChI=1S/C28H28O13/c1-12-4-15(29)7-18(32)23(12)26(36)39-10-21(35)22(41-28(38)25-14(3)6-17(31)9-20(25)34)11-40-27(37)24-13(2)5-16(30)8-19(24)33/h4-9,21-22,29-35H,10-11H2,1-3H3/t21-,22+/m0/s1

inchikey

  • ORDILPIXIUWRFL-FCHUYYIVSA-N

mass

  • 572.519

monoisotopicmass

  • 572.15299

smiles

  • O=C(O[C@@H]([C@@H](O)COC(=O)C1=C(O)C=C(O)C=C1C)COC(=O)C2=C(O)C=C(O)C=C2C)C3=C(O)C=C(O)C=C3C

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R)-3,4-bis[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-hydroxybutyl] 2,4-dihydroxy-6-methylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214716

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