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Concept information

Preferred term

Aquifoliunine EII  

Type

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

charge

  • 0

formula

  • C34H43NO16

inchi

  • InChI=1S/C34H43NO16/c1-14-15(2)29(42)50-26-24(41)28(49-19(6)39)33(13-45-16(3)36)27(48-18(5)38)23(40)21-25(47-17(4)37)34(33,32(26,8)44)51-31(21,7)12-46-30(43)20-10-9-11-35-22(14)20/h9-11,14-15,21,23-28,40-41,44H,12-13H2,1-8H3

inchikey

  • SHDBRMQJPSDFRT-UHFFFAOYSA-N

mass

  • 721.709

monoisotopicmass

  • 721.25818

smiles

  • O1C23C4(C(OC(=O)C)C(O)C(C2OC(=O)C)C1(COC(=O)C5=C(N=CC=C5)C(C(C(OC(C3(O)C)C(O)C4OC(=O)C)=O)C)C)C)COC(=O)C

subset

  • 2_STAR

synonym EXACT

  • (19,21,24-triacetyloxy-18,22,25-trihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl)methyl acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191575

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