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Concept information

Preferred term

melongoside n  

Type

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

Broader concept

charge

  • 0

formula

  • C45H76O19

inchi

  • InChI=1S/C45H76O19/c1-19(18-58-40-37(55)34(52)31(49)27(15-46)60-40)7-12-45(57)20(2)30-26(64-45)14-25-23-6-5-21-13-22(8-10-43(21,3)24(23)9-11-44(25,30)4)59-42-39(36(54)33(51)29(17-48)62-42)63-41-38(56)35(53)32(50)28(16-47)61-41/h19-42,46-57H,5-18H2,1-4H3

inchikey

  • SORUXVRKWOHYEO-UHFFFAOYSA-N

mass

  • 921.084

monoisotopicmass

  • 920.49808

smiles

  • O1C2C(C3(C(C4C(C5(C(CC4)CC(OC6OC(C(O)C(O)C6OC7OC(C(O)C(O)C7O)CO)CO)CC5)C)CC3)C2)C)C(C1(O)CCC(COC8OC(C(O)C(O)C8O)CO)C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[4-[16-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197122

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